[(3S)-7-chloranyl-2-oxidanylidene-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl]methyl ethanoate

Systemtic Name: [(3S)-7-chloranyl-2-oxidanylidene-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl]methyl ethanoate Openeye Name: [(3S)-7-chloro-2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl]methyl acetate CAS Name: acetic acid [(3S)-7-chloro-2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl]methyl ester IUPAC Name: [(3S)-7-chloro-2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl]methyl acetate Traditional Name: acetic acid [(3S)-7-chloro-2-keto-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl]methyl ester Formula: C18H15ClN2O3 MolecularWeight: 342.7763

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1C(=O)NC2=C(C=C(C=C2)Cl)C(=N1)C3=CC=CC=C3

Isomeric SMILES

CC(=O)OC[C@H]1C(=O)NC2=C(C=C(C=C2)Cl)C(=N1)C3=CC=CC=C3

InChI

InChI=1S/C18H15ClN2O3/c1-11(22)24-10-16-18(23)21-15-8-7-13(19)9-14(15)17(20-16)12-5-3-2-4-6-12/h2-9,16H,10H2,1H3,(H,21,23)/t16-/m0/s1