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

Systemtic Name: [7-bromanyl-5-(2-chlorophenyl)-1-ethanoyl-5-ethoxy-2-oxidanylidene-3,4-dihydro-1,4-benzodiazepin-3-yl] ethanoate Openeye Name: [1-acetyl-7-bromo-5-(2-chlorophenyl)-5-ethoxy-2-oxo-3,4-dihydro-1,4-benzodiazepin-3-yl] acetate CAS Name: acetic acid [1-acetyl-7-bromo-5-(2-chlorophenyl)-5-ethoxy-2-oxo-3,4-dihydro-1,4-benzodiazepin-3-yl] ester IUPAC Name: [1-acetyl-7-bromo-5-(2-chlorophenyl)-5-ethoxy-2-oxo-3,4-dihydro-1,4-benzodiazepin-3-yl] acetate Traditional Name: acetic acid [1-acetyl-7-bromo-5-(2-chlorophenyl)-5-ethoxy-2-keto-3,4-dihydro-1,4-benzodiazepin-3-yl] ester Formula: C21H20BrClN2O5 MolecularWeight: 495.7509

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1(C2=C(C=CC(=C2)Br)N(C(=O)C(N1)OC(=O)C)C(=O)C)C3=CC=CC=C3Cl

Isomeric SMILES

CCOC1(C2=C(C=CC(=C2)Br)N(C(=O)C(N1)OC(=O)C)C(=O)C)C3=CC=CC=C3Cl

InChI

InChI=1S/C21H20BrClN2O5/c1-4-29-21(15-7-5-6-8-17(15)23)16-11-14(22)9-10-18(16)25(12(2)26)20(28)19(24-21)30-13(3)27/h5-11,19,24H,4H2,1-3H3