11-[2-[bis(2-hydroxyethyl)amino]ethanoyl]-3-chloranyl-5H-benzo[b][1,4]benzodiazepin-6-one hydrochloride

Systemtic Name: 11-[2-[bis(2-hydroxyethyl)amino]ethanoyl]-3-chloranyl-5H-benzo[b][1,4]benzodiazepin-6-one hydrochloride Openeye Name: 11-[2-[bis(2-hydroxyethyl)amino]acetyl]-3-chloro-5H-benzo[b][1,4]benzodiazepin-6-one hydrochloride CAS Name: 11-[2-[bis(2-hydroxyethyl)amino]-1-oxoethyl]-3-chloro-5H-benzo[b][1,4]benzodiazepin-6-one hydrochloride IUPAC Name: 11-[2-[bis(2-hydroxyethyl)amino]acetyl]-3-chloro-5H-benzo[b][1,4]benzodiazepin-6-one hydrochloride Traditional Name: 11-[2-[bis(2-hydroxyethyl)amino]acetyl]-3-chloro-5H-benzo[b][1,4]benzodiazepin-6-one hydrochloride Formula: C19H21Cl2N3O4 MolecularWeight: 426.29374

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)NC3=C(N2C(=O)CN(CCO)CCO)C=CC(=C3)Cl.Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)NC3=C(N2C(=O)CN(CCO)CCO)C=CC(=C3)Cl.Cl

InChI

InChI=1S/C19H20ClN3O4.ClH/c20-13-5-6-17-15(11-13)21-19(27)14-3-1-2-4-16(14)23(17)18(26)12-22(7-9-24)8-10-25;/h1-6,11,24-25H,7-10,12H2,(H,21,27);1H