[(2S)-1-[(4-chlorophenyl)amino]-1-oxidanylidene-propan-2-yl] 4-(aminocarbonylamino)butanoate

Systemtic Name: [(2S)-1-[(4-chlorophenyl)amino]-1-oxidanylidene-propan-2-yl] 4-(aminocarbonylamino)butanoate Openeye Name: [(1S)-2-(4-chloroanilino)-1-methyl-2-oxo-ethyl] 4-ureidobutanoate CAS Name: 4-(carbamoylamino)butanoic acid [(2S)-1-(4-chloroanilino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(4-chloroanilino)-1-oxopropan-2-yl] 4-(carbamoylamino)butanoate Traditional Name: 4-ureidobutyric acid [(1S)-2-(4-chloroanilino)-2-keto-1-methyl-ethyl] ester Formula: C14H18ClN3O4 MolecularWeight: 327.76342

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)Cl)OC(=O)CCCNC(=O)N

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=C(C=C1)Cl)OC(=O)CCCNC(=O)N

InChI

InChI=1S/C14H18ClN3O4/c1-9(22-12(19)3-2-8-17-14(16)21)13(20)18-11-6-4-10(15)5-7-11/h4-7,9H,2-3,8H2,1H3,(H,18,20)(H3,16,17,21)/t9-/m0/s1