2-[2-[(4-chlorophenyl)carbamoylamino]ethanoylamino]-3-methyl-butanoic acid

Systemtic Name: 2-[2-[(4-chlorophenyl)carbamoylamino]ethanoylamino]-3-methyl-butanoic acid Openeye Name: 2-[[2-[(4-chlorophenyl)carbamoylamino]acetyl]amino]-3-methyl-butanoic acid CAS Name: 2-[[2-[[(4-chloroanilino)-oxomethyl]amino]-1-oxoethyl]amino]-3-methylbutanoic acid IUPAC Name: 2-[[2-[(4-chlorophenyl)carbamoylamino]acetyl]amino]-3-methylbutanoic acid Traditional Name: 2-[[2-[(4-chlorophenyl)carbamoylamino]acetyl]amino]-3-methyl-butyric acid Formula: C14H18ClN3O4 MolecularWeight: 327.76342

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC(=O)CNC(=O)NC1=CC=C(C=C1)Cl

Isomeric SMILES

CC(C)C(C(=O)O)NC(=O)CNC(=O)NC1=CC=C(C=C1)Cl

InChI

InChI=1S/C14H18ClN3O4/c1-8(2)12(13(20)21)18-11(19)7-16-14(22)17-10-5-3-9(15)4-6-10/h3-6,8,12H,7H2,1-2H3,(H,18,19)(H,20,21)(H2,16,17,22)