2-[(3-chloranyl-4-methyl-phenyl)carbamoylamino]-4-methyl-pentanoic acid

Systemtic Name: 2-[(3-chloranyl-4-methyl-phenyl)carbamoylamino]-4-methyl-pentanoic acid Openeye Name: 2-[(3-chloro-4-methyl-phenyl)carbamoylamino]-4-methyl-pentanoic acid CAS Name: 2-[[(3-chloro-4-methylanilino)-oxomethyl]amino]-4-methylpentanoic acid IUPAC Name: 2-[(3-chloro-4-methylphenyl)carbamoylamino]-4-methylpentanoic acid Traditional Name: 2-[(3-chloro-4-methyl-phenyl)carbamoylamino]-4-methyl-valeric acid Formula: C14H19ClN2O3 MolecularWeight: 298.76526

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19ClN2O3/c1-8(2)6-12(13(18)19)17-14(20)16-10-5-4-9(3)11(15)7-10/h4-5,7-8,12H,6H2,1-3H3,(H,18,19)(H2,16,17,20)