[2-oxidanylidene-2-[4-(propanoylamino)phenyl]ethyl] 2-(aminocarbonylamino)-4-methyl-pentanoate

Systemtic Name: [2-oxidanylidene-2-[4-(propanoylamino)phenyl]ethyl] 2-(aminocarbonylamino)-4-methyl-pentanoate Openeye Name: [2-oxo-2-[4-(propanoylamino)phenyl]ethyl] 4-methyl-2-ureido-pentanoate CAS Name: 2-(carbamoylamino)-4-methylpentanoic acid [2-oxo-2-[4-(1-oxopropylamino)phenyl]ethyl] ester IUPAC Name: [2-oxo-2-[4-(propanoylamino)phenyl]ethyl] 2-(carbamoylamino)-4-methylpentanoate Traditional Name: 4-methyl-2-ureido-valeric acid [2-keto-2-(4-propionamidophenyl)ethyl] ester Formula: C18H25N3O5 MolecularWeight: 363.4082

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=C(C=C1)C(=O)COC(=O)C(CC(C)C)NC(=O)N

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)C(=O)COC(=O)C(CC(C)C)NC(=O)N

InChI

InChI=1S/C18H25N3O5/c1-4-16(23)20-13-7-5-12(6-8-13)15(22)10-26-17(24)14(9-11(2)3)21-18(19)25/h5-8,11,14H,4,9-10H2,1-3H3,(H,20,23)(H3,19,21,25)