methyl 4-methyl-3-[2-[(phenylmethyl)carbamoylamino]ethanoylamino]benzoate

Systemtic Name: methyl 4-methyl-3-[2-[(phenylmethyl)carbamoylamino]ethanoylamino]benzoate Openeye Name: methyl 3-[[2-(benzylcarbamoylamino)acetyl]amino]-4-methyl-benzoate CAS Name: 4-methyl-3-[[1-oxo-2-[[oxo-[(phenylmethyl)amino]methyl]amino]ethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[2-(benzylcarbamoylamino)acetyl]amino]-4-methylbenzoate Traditional Name: 3-[[2-(benzylcarbamoylamino)acetyl]amino]-4-methyl-benzoic acid methyl ester Formula: C19H21N3O4 MolecularWeight: 355.38774

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CNC(=O)NCC2=CC=CC=C2

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CNC(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C19H21N3O4/c1-13-8-9-15(18(24)26-2)10-16(13)22-17(23)12-21-19(25)20-11-14-6-4-3-5-7-14/h3-10H,11-12H2,1-2H3,(H,22,23)(H2,20,21,25)