4-[2-(4-butylphenyl)ethanoyl-methyl-amino]butanoic acid

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)CC(=O)N(C)CCCC(=O)O

Isomeric SMILES

CCCCC1=CC=C(C=C1)CC(=O)N(C)CCCC(=O)O

InChI

InChI=1S/C17H25NO3/c1-3-4-6-14-8-10-15(11-9-14)13-16(19)18(2)12-5-7-17(20)21/h8-11H,3-7,12-13H2,1-2H3,(H,20,21)