[2-[[3-(ethylcarbamoyl)phenyl]amino]-2-oxidanylidene-ethyl] 3-(2-phenylethanoylamino)propanoate

Systemtic Name: [2-[[3-(ethylcarbamoyl)phenyl]amino]-2-oxidanylidene-ethyl] 3-(2-phenylethanoylamino)propanoate Openeye Name: [2-[3-(ethylcarbamoyl)anilino]-2-oxo-ethyl] 3-[(2-phenylacetyl)amino]propanoate CAS Name: 3-[(1-oxo-2-phenylethyl)amino]propanoic acid [2-[3-(ethylcarbamoyl)anilino]-2-oxoethyl] ester IUPAC Name: [2-[3-(ethylcarbamoyl)anilino]-2-oxoethyl] 3-[(2-phenylacetyl)amino]propanoate Traditional Name: 3-[(2-phenylacetyl)amino]propionic acid [2-[3-(ethylcarbamoyl)anilino]-2-keto-ethyl] ester Formula: C22H25N3O5 MolecularWeight: 411.451

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=CC(=CC=C1)NC(=O)COC(=O)CCNC(=O)CC2=CC=CC=C2

Isomeric SMILES

CCNC(=O)C1=CC(=CC=C1)NC(=O)COC(=O)CCNC(=O)CC2=CC=CC=C2

InChI

InChI=1S/C22H25N3O5/c1-2-23-22(29)17-9-6-10-18(14-17)25-20(27)15-30-21(28)11-12-24-19(26)13-16-7-4-3-5-8-16/h3-10,14H,2,11-13,15H2,1H3,(H,23,29)(H,24,26)(H,25,27)