7-Ethyl-12,13-dimethoxy-6-oxo-6,7,9,10-tetrahydro-5H-isoquinolino[2,1-d][1,4]benzodiazepin-8-ium bromide

ChemSpider ID: 37660
Molecular Formula: C₂₁H₂₃BrN₂O₃
Monoisotopic mass: 430.089203 Da
Systematic name

7-Ethyl-12,13-dimethoxy-6-oxo-6,7,9,10-tetrahydro-5H-isoquinolino[2,1-d][1,4]benzodiazepin-8-ium bromide
SMILES and InChIs

SMILES:

[Br-].O=C3Nc4ccccc4C=2c1c(cc(OC)c(OC)c1)CC[N+]=2C3CC Copied

Std. InChI:

InChI=1S/C21H22N2O3.BrH/c1-4-17-21(24)22-16-8-6-5-7-14(16)20-15-12-19(26-3)18(25-2)11-13(15)9-10-23(17)20;/h5-8,11-12,17H,4,9-10H2,1-3H3;1H Copied

Std. InChIKey:

PJQKUXJLYYANJH-UHFFFAOYSA-N Copied

Names and Identifiers

Predicted data is generated using the ACD/Labs’ ACD/PhysChem Suite, for more information see their website.

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