2-(3-methyl-2-oxidanylidene-5-phenyl-1,3-dihydro-1,4-benzodiazepin-7-yl)propanoic acid

Systemtic Name: 2-(3-methyl-2-oxidanylidene-5-phenyl-1,3-dihydro-1,4-benzodiazepin-7-yl)propanoic acid Openeye Name: 2-(3-methyl-2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepin-7-yl)propanoic acid CAS Name: 2-(3-methyl-2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepin-7-yl)propanoic acid IUPAC Name: 2-(3-methyl-2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepin-7-yl)propanoic acid Traditional Name: 2-(2-keto-3-methyl-5-phenyl-1,3-dihydro-1,4-benzodiazepin-7-yl)propionic acid Formula: C19H18N2O3 MolecularWeight: 322.35782

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)NC2=C(C=C(C=C2)C(C)C(=O)O)C(=N1)C3=CC=CC=C3

Isomeric SMILES

CC1C(=O)NC2=C(C=C(C=C2)C(C)C(=O)O)C(=N1)C3=CC=CC=C3

InChI

InChI=1S/C19H18N2O3/c1-11(19(23)24)14-8-9-16-15(10-14)17(13-6-4-3-5-7-13)20-12(2)18(22)21-16/h3-12H,1-2H3,(H,21,22)(H,23,24)