3-[(3-chloranyl-4-methyl-phenyl)carbamoylamino]butanoic acid

Systemtic Name: 3-[(3-chloranyl-4-methyl-phenyl)carbamoylamino]butanoic acid Openeye Name: 3-[(3-chloro-4-methyl-phenyl)carbamoylamino]butanoic acid CAS Name: 3-[[(3-chloro-4-methylanilino)-oxomethyl]amino]butanoic acid IUPAC Name: 3-[(3-chloro-4-methylphenyl)carbamoylamino]butanoic acid Traditional Name: 3-[(3-chloro-4-methyl-phenyl)carbamoylamino]butyric acid Formula: C12H15ClN2O3 MolecularWeight: 270.7121

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)NC(C)CC(=O)O)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)NC(C)CC(=O)O)Cl

InChI

InChI=1S/C12H15ClN2O3/c1-7-3-4-9(6-10(7)13)15-12(18)14-8(2)5-11(16)17/h3-4,6,8H,5H2,1-2H3,(H,16,17)(H2,14,15,18)