(3-azanyl-3-oxidanylidene-propyl) 2-[(2-methylphenyl)carbonylamino]ethanoate

Systemtic Name: (3-azanyl-3-oxidanylidene-propyl) 2-[(2-methylphenyl)carbonylamino]ethanoate Openeye Name: (3-amino-3-oxo-propyl) 2-[(2-methylbenzoyl)amino]acetate CAS Name: 2-[[(2-methylphenyl)-oxomethyl]amino]acetic acid (3-amino-3-oxopropyl) ester IUPAC Name: (3-amino-3-oxopropyl) 2-[(2-methylbenzoyl)amino]acetate Traditional Name: 2-(o-toluoylamino)acetic acid (3-amino-3-keto-propyl) ester Formula: C13H16N2O4 MolecularWeight: 264.27714

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NCC(=O)OCCC(=O)N

Isomeric SMILES

CC1=CC=CC=C1C(=O)NCC(=O)OCCC(=O)N

InChI

InChI=1S/C13H16N2O4/c1-9-4-2-3-5-10(9)13(18)15-8-12(17)19-7-6-11(14)16/h2-5H,6-8H2,1H3,(H2,14,16)(H,15,18)