[(3R)-7-bromanyl-5-(2-chlorophenyl)-1-ethanoyl-2-oxidanylidene-3H-1,4-benzodiazepin-3-yl] ethanoate

Systemtic Name: [(3R)-7-bromanyl-5-(2-chlorophenyl)-1-ethanoyl-2-oxidanylidene-3H-1,4-benzodiazepin-3-yl] ethanoate Openeye Name: [(3R)-1-acetyl-7-bromo-5-(2-chlorophenyl)-2-oxo-3H-1,4-benzodiazepin-3-yl] acetate CAS Name: acetic acid [(3R)-1-acetyl-7-bromo-5-(2-chlorophenyl)-2-oxo-3H-1,4-benzodiazepin-3-yl] ester IUPAC Name: [(3R)-1-acetyl-7-bromo-5-(2-chlorophenyl)-2-oxo-3H-1,4-benzodiazepin-3-yl] acetate Traditional Name: acetic acid [(3R)-1-acetyl-7-bromo-5-(2-chlorophenyl)-2-keto-3H-1,4-benzodiazepin-3-yl] ester Formula: C19H14BrClN2O4 MolecularWeight: 449.68246

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C2=C(C=C(C=C2)Br)C(=NC(C1=O)OC(=O)C)C3=CC=CC=C3Cl

Isomeric SMILES

CC(=O)N1C2=C(C=C(C=C2)Br)C(=N[C@@H](C1=O)OC(=O)C)C3=CC=CC=C3Cl

InChI

InChI=1S/C19H14BrClN2O4/c1-10(24)23-16-8-7-12(20)9-14(16)17(13-5-3-4-6-15(13)21)22-18(19(23)26)27-11(2)25/h3-9,18H,1-2H3/t18-/m1/s1