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
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Found 6 results

Search term: ASTCUURTJCZRSC (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
141283

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C16H18ClN.ClH/c1-13(11-14-7-3-2-4-8-14)18-12-15-9-5-6-10-16(15)17;/h2-10,13,18H,11-12H2,1H3;1H
C16H19Cl2N296.23476395200
32699190

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C16H18ClN.ClH/c1-13(11-14-7-3-2-4-8-14)18-12-15-9-5-6-10-16(15)17;/h2-10,13,18H,11-12H2,1H3;1H/t13-;/m0./s1
C16H19Cl2N296.23485600
48058149

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C16H18ClN.ClH/c1-13(11-14-7-3-2-4-8-14)18-12-15-9-5-6-10-16(15)17;/h2-10,13,18H,11-12H2,1H3;1H/i1D3,11D2,13D;
C16H13D6Cl2N302.27174400
58780732

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C16H18ClN.ClH/c1-13(11-14-7-3-2-4-8-14)18-12-15-9-5-6-10-16(15)17;/h2-10,13,18H,11-12H2,1H3;1H/t13-;/m1./s1
C16H19Cl2N296.23483700
48058148

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C16H18ClN.ClH/c1-13(11-14-7-3-2-4-8-14)18-12-15-9-5-6-10-16(15)17;/h2-10,13,18H,11-12H2,1H3;1H/t13-;/m0./s1/i1D3;
C16H16D3Cl2N299.25322300
76920263

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C16H18ClN.ClH/c1-13(11-14-7-3-2-4-8-14)18-12-15-9-5-6-10-16(15)17;/h2-10,13,18H,11-12H2,1H3;1H/t13-;/m1./s1/i1D3;
C16H16D3Cl2N299.25321100

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