[2-oxidanylidene-2-[phenethyl-(phenylmethyl)amino]ethyl] 3-[(2-methylphenyl)carbonylamino]propanoate

Systemtic Name: [2-oxidanylidene-2-[phenethyl-(phenylmethyl)amino]ethyl] 3-[(2-methylphenyl)carbonylamino]propanoate Openeye Name: [2-[benzyl(phenethyl)amino]-2-oxo-ethyl] 3-[(2-methylbenzoyl)amino]propanoate CAS Name: 3-[[(2-methylphenyl)-oxomethyl]amino]propanoic acid [2-oxo-2-[phenethyl-(phenylmethyl)amino]ethyl] ester IUPAC Name: [2-[benzyl(phenethyl)amino]-2-oxoethyl] 3-[(2-methylbenzoyl)amino]propanoate Traditional Name: 3-(o-toluoylamino)propionic acid [2-[benzyl(phenethyl)amino]-2-keto-ethyl] ester Formula: C28H30N2O4 MolecularWeight: 458.5488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NCCC(=O)OCC(=O)N(CCC2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC=C1C(=O)NCCC(=O)OCC(=O)N(CCC2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C28H30N2O4/c1-22-10-8-9-15-25(22)28(33)29-18-16-27(32)34-21-26(31)30(20-24-13-6-3-7-14-24)19-17-23-11-4-2-5-12-23/h2-15H,16-21H2,1H3,(H,29,33)