2-[(4-butylphenyl)carbonylamino]-3-methyl-butanoic acid

Systemtic Name: 2-[(4-butylphenyl)carbonylamino]-3-methyl-butanoic acid Openeye Name: 2-[(4-butylbenzoyl)amino]-3-methyl-butanoic acid CAS Name: 2-[[(4-butylphenyl)-oxomethyl]amino]-3-methylbutanoic acid IUPAC Name: 2-[(4-butylbenzoyl)amino]-3-methylbutanoic acid Traditional Name: 2-[(4-butylbenzoyl)amino]-3-methyl-butyric acid Formula: C16H23NO3 MolecularWeight: 277.35872

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)NC(C(C)C)C(=O)O

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)NC(C(C)C)C(=O)O

InChI

InChI=1S/C16H23NO3/c1-4-5-6-12-7-9-13(10-8-12)15(18)17-14(11(2)3)16(19)20/h7-11,14H,4-6H2,1-3H3,(H,17,18)(H,19,20)