3-[(4-chlorophenyl)-(3-methylbutanoyl)amino]propanoate

Systemtic Name: 3-[(4-chlorophenyl)-(3-methylbutanoyl)amino]propanoate Openeye Name: 3-[4-chloro-N-(3-methylbutanoyl)anilino]propanoate CAS Name: 3-(4-chloro-N-(3-methyl-1-oxobutyl)anilino)propanoate IUPAC Name: 3-[4-chloro-N-(3-methylbutanoyl)anilino]propanoate Traditional Name: 3-(4-chloro-N-isovaleryl-anilino)propionate Formula: C14H17ClNO3- MolecularWeight: 282.74268

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N(CCC(=O)[O-])C1=CC=C(C=C1)Cl

Isomeric SMILES

CC(C)CC(=O)N(CCC(=O)[O-])C1=CC=C(C=C1)Cl

InChI

InChI=1S/C14H18ClNO3/c1-10(2)9-13(17)16(8-7-14(18)19)12-5-3-11(15)4-6-12/h3-6,10H,7-9H2,1-2H3,(H,18,19)/p-1