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

Systemtic Name: [2-acetyloxy-3-(7-chloranyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-1-yl)propyl] ethanoate Openeye Name: [2-acetoxy-3-(7-chloro-2-oxo-5-phenyl-3H-1,4-benzodiazepin-1-yl)propyl] acetate CAS Name: acetic acid [2-acetyloxy-3-(7-chloro-2-oxo-5-phenyl-3H-1,4-benzodiazepin-1-yl)propyl] ester IUPAC Name: [2-acetyloxy-3-(7-chloro-2-oxo-5-phenyl-3H-1,4-benzodiazepin-1-yl)propyl] acetate Traditional Name: acetic acid [2-acetoxy-3-(7-chloro-2-keto-5-phenyl-3H-1,4-benzodiazepin-1-yl)propyl] ester Formula: C22H21ClN2O5 MolecularWeight: 428.86554

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC(CN1C(=O)CN=C(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3)OC(=O)C

Isomeric SMILES

CC(=O)OCC(CN1C(=O)CN=C(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3)OC(=O)C

InChI

InChI=1S/C22H21ClN2O5/c1-14(26)29-13-18(30-15(2)27)12-25-20-9-8-17(23)10-19(20)22(24-11-21(25)28)16-6-4-3-5-7-16/h3-10,18H,11-13H2,1-2H3