Matches any text strings used to describe a molecule.
Systematic Name, Synonym, Trade Name, Registry Number, SMILES, InChI or CSID

Systematic names 1,2-dihydroxybenzene
Synonyms AIBN
Trade names Aspirin
Registry numbers 7732-18-5
SMILES O=C(OCC)C
InChl InChI=1/CH4/h1H4
Search Hits Limit:
Single/Multi-component
Isotopically Labeled
Additional Filters

Found 5 results

Search term: DOUZLKPMUCNEOS (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4585310

Double-bond stereo

0 of 11 defined stereocentres - 0/11 defined
InChI=1/C40H46N4O2/c1-4-24-20-41-16-14-39-30-11-7-9-13-32(30)44-36(39)28(26(24)18-33(39)41)22-46-38(44)35-27-19-34-40(15-17-42(34)21-25(27)5-2)29-10-6-8-12-31(29)43(23(3)45)37(35)40/h4-13,26-28,33-38H,14-22H2,1-3H3/b24-4+,25-5+
C40H46N4O2614.81884400
31109856

Double-bond stereo

11 of 11 defined stereocentres - 11/11 defined
InChI=1/C40H46N4O2/c1-4-24-20-41-16-14-39-30-11-7-9-13-32(30)44-36(39)28(26(24)18-33(39)41)22-46-38(44)35-27-19-34-40(15-17-42(34)21-25(27)5-2)29-10-6-8-12-31(29)43(23(3)45)37(35)40/h4-13,26-28,33-38H,14-22H2,1-3H3/b24-4+,25-5+/t26-,27-,28+,33-,34-,35+,36-,37-,38+,39+,40+/m0/s1
C40H46N4O2614.81882200
383121

Double-bond stereo

0 of 11 defined stereocentres - 0/11 defined
InChI=1/C40H46N4O2/c1-4-24-20-41-16-14-39-30-11-7-9-13-32(30)44-36(39)28(26(24)18-33(39)41)22-46-38(44)35-27-19-34-40(15-17-42(34)21-25(27)5-2)29-10-6-8-12-31(29)43(23(3)45)37(35)40/h4-13,26-28,33-38H,14-22H2,1-3H3
C40H46N4O2614.81882100
95637780

Double-bond stereo

0 of 11 defined stereocentres - 0/11 defined
InChI=1/C40H46N4O2/c1-4-24-20-41-16-14-39-30-11-7-9-13-32(30)44-36(39)28(26(24)18-33(39)41)22-46-38(44)35-27-19-34-40(15-17-42(34)21-25(27)5-2)29-10-6-8-12-31(29)43(23(3)45)37(35)40/h4-13,26-28,33-38H,14-22H2,1-3H3/b24-4-,25-5u
C40H46N4O2614.81882200
95637779

Double-bond stereo

0 of 11 defined stereocentres - 0/11 defined
InChI=1/C40H46N4O2/c1-4-24-20-41-16-14-39-30-11-7-9-13-32(30)44-36(39)28(26(24)18-33(39)41)22-46-38(44)35-27-19-34-40(15-17-42(34)21-25(27)5-2)29-10-6-8-12-31(29)43(23(3)45)37(35)40/h4-13,26-28,33-38H,14-22H2,1-3H3/b24-4-,25-5+
C40H46N4O2614.81881100

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