[7-chloranyl-1-(2-hydroxyethyl)-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl] ethanoate

Systemtic Name: [7-chloranyl-1-(2-hydroxyethyl)-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl] ethanoate Openeye Name: [7-chloro-1-(2-hydroxyethyl)-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl] acetate CAS Name: acetic acid [7-chloro-1-(2-hydroxyethyl)-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl] ester IUPAC Name: [7-chloro-1-(2-hydroxyethyl)-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl] acetate Traditional Name: acetic acid [7-chloro-1-(2-hydroxyethyl)-2-keto-5-phenyl-3H-1,4-benzodiazepin-3-yl] ester Formula: C19H17ClN2O4 MolecularWeight: 372.80228

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C(=O)N(C2=C(C=C(C=C2)Cl)C(=N1)C3=CC=CC=C3)CCO

Isomeric SMILES

CC(=O)OC1C(=O)N(C2=C(C=C(C=C2)Cl)C(=N1)C3=CC=CC=C3)CCO

InChI

InChI=1S/C19H17ClN2O4/c1-12(24)26-18-19(25)22(9-10-23)16-8-7-14(20)11-15(16)17(21-18)13-5-3-2-4-6-13/h2-8,11,18,23H,9-10H2,1H3