2-[4-(4-chlorophenyl)carbonyl-2-oxidanylidene-3,5-dihydro-1,4-benzodiazepin-1-yl]ethanoic acid

Systemtic Name: 2-[4-(4-chlorophenyl)carbonyl-2-oxidanylidene-3,5-dihydro-1,4-benzodiazepin-1-yl]ethanoic acid Openeye Name: 2-[4-(4-chlorobenzoyl)-2-oxo-3,5-dihydro-1,4-benzodiazepin-1-yl]acetic acid CAS Name: 2-[4-[(4-chlorophenyl)-oxomethyl]-2-oxo-3,5-dihydro-1,4-benzodiazepin-1-yl]acetic acid IUPAC Name: 2-[4-(4-chlorobenzoyl)-2-oxo-3,5-dihydro-1,4-benzodiazepin-1-yl]acetic acid Traditional Name: 2-[4-(4-chlorobenzoyl)-2-keto-3,5-dihydro-1,4-benzodiazepin-1-yl]acetic acid Formula: C18H15ClN2O4 MolecularWeight: 358.7757

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2N(C(=O)CN1C(=O)C3=CC=C(C=C3)Cl)CC(=O)O

Isomeric SMILES

C1C2=CC=CC=C2N(C(=O)CN1C(=O)C3=CC=C(C=C3)Cl)CC(=O)O

InChI

InChI=1S/C18H15ClN2O4/c19-14-7-5-12(6-8-14)18(25)20-9-13-3-1-2-4-15(13)21(11-17(23)24)16(22)10-20/h1-8H,9-11H2,(H,23,24)