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

Systemtic Name: 2-[1-methyl-3-(methylamino)-4-oxidanylidene-2,3-dihydro-1,5-benzodiazepin-5-yl]ethanoic acid Openeye Name: 2-[1-methyl-3-(methylamino)-4-oxo-2,3-dihydro-1,5-benzodiazepin-5-yl]acetic acid CAS Name: 2-[1-methyl-3-(methylamino)-4-oxo-2,3-dihydro-1,5-benzodiazepin-5-yl]acetic acid IUPAC Name: 2-[1-methyl-3-(methylamino)-4-oxo-2,3-dihydro-1,5-benzodiazepin-5-yl]acetic acid Traditional Name: 2-[4-keto-1-methyl-3-(methylamino)-2,3-dihydro-1,5-benzodiazepin-5-yl]acetic acid Formula: C13H17N3O3 MolecularWeight: 263.29238

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Descriptors Computed from Structure

Canonical SMILES:

CNC1CN(C2=CC=CC=C2N(C1=O)CC(=O)O)C

Isomeric SMILES

CNC1CN(C2=CC=CC=C2N(C1=O)CC(=O)O)C

InChI

InChI=1S/C13H17N3O3/c1-14-9-7-15(2)10-5-3-4-6-11(10)16(13(9)19)8-12(17)18/h3-6,9,14H,7-8H2,1-2H3,(H,17,18)