methyl 4-[[2-[(4-methylphenyl)methylcarbamoylamino]ethanoylamino]methyl]benzoate

Systemtic Name: methyl 4-[[2-[(4-methylphenyl)methylcarbamoylamino]ethanoylamino]methyl]benzoate Openeye Name: methyl 4-[[[2-(p-tolylmethylcarbamoylamino)acetyl]amino]methyl]benzoate CAS Name: 4-[[[2-[[[(4-methylphenyl)methylamino]-oxomethyl]amino]-1-oxoethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[2-[(4-methylphenyl)methylcarbamoylamino]acetyl]amino]methyl]benzoate Traditional Name: 4-[[[2-[(4-methylbenzyl)carbamoylamino]acetyl]amino]methyl]benzoic acid methyl ester Formula: C20H23N3O4 MolecularWeight: 369.41432

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23N3O4/c1-14-3-5-15(6-4-14)12-22-20(26)23-13-18(24)21-11-16-7-9-17(10-8-16)19(25)27-2/h3-10H,11-13H2,1-2H3,(H,21,24)(H2,22,23,26)