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

Systemtic Name: 3-(4-methyl-2-oxidanylidene-3,4-dihydro-1H-1,5-benzodiazepin-5-yl)propanoic acid Openeye Name: 3-(4-methyl-2-oxo-3,4-dihydro-1H-1,5-benzodiazepin-5-yl)propanoic acid CAS Name: 3-(4-methyl-2-oxo-3,4-dihydro-1H-1,5-benzodiazepin-5-yl)propanoic acid IUPAC Name: 3-(4-methyl-2-oxo-3,4-dihydro-1H-1,5-benzodiazepin-5-yl)propanoic acid Traditional Name: 3-(2-keto-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-5-yl)propionic acid Formula: C13H16N2O3 MolecularWeight: 248.27774

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)NC2=CC=CC=C2N1CCC(=O)O

Isomeric SMILES

CC1CC(=O)NC2=CC=CC=C2N1CCC(=O)O

InChI

InChI=1S/C13H16N2O3/c1-9-8-12(16)14-10-4-2-3-5-11(10)15(9)7-6-13(17)18/h2-5,9H,6-8H2,1H3,(H,14,16)(H,17,18)