[2-oxidanylidene-2-[(4-phenylphenyl)amino]ethyl] 6-(aminocarbonylamino)hexanoate

Systemtic Name: [2-oxidanylidene-2-[(4-phenylphenyl)amino]ethyl] 6-(aminocarbonylamino)hexanoate Openeye Name: [2-oxo-2-(4-phenylanilino)ethyl] 6-ureidohexanoate CAS Name: 6-(carbamoylamino)hexanoic acid [2-oxo-2-(4-phenylanilino)ethyl] ester IUPAC Name: [2-oxo-2-(4-phenylanilino)ethyl] 6-(carbamoylamino)hexanoate Traditional Name: 6-ureidohexanoic acid [2-keto-2-(4-phenylanilino)ethyl] ester Formula: C21H25N3O4 MolecularWeight: 383.4409

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)NC(=O)COC(=O)CCCCCNC(=O)N

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)NC(=O)COC(=O)CCCCCNC(=O)N

InChI

InChI=1S/C21H25N3O4/c22-21(27)23-14-6-2-5-9-20(26)28-15-19(25)24-18-12-10-17(11-13-18)16-7-3-1-4-8-16/h1,3-4,7-8,10-13H,2,5-6,9,14-15H2,(H,24,25)(H3,22,23,27)