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

Systemtic Name: 2-[2-(4-butylphenyl)ethanoylamino]-3-methyl-butanoic acid Openeye Name: 2-[[2-(4-butylphenyl)acetyl]amino]-3-methyl-butanoic acid CAS Name: 2-[[2-(4-butylphenyl)-1-oxoethyl]amino]-3-methylbutanoic acid IUPAC Name: 2-[[2-(4-butylphenyl)acetyl]amino]-3-methylbutanoic acid Traditional Name: 2-[[2-(4-butylphenyl)acetyl]amino]-3-methyl-butyric acid Formula: C17H25NO3 MolecularWeight: 291.3853

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H25NO3/c1-4-5-6-13-7-9-14(10-8-13)11-15(19)18-16(12(2)3)17(20)21/h7-10,12,16H,4-6,11H2,1-3H3,(H,18,19)(H,20,21)