4-[heptyl-(phenylmethyl)amino]butanoic acid

Systemtic Name: 4-[heptyl-(phenylmethyl)amino]butanoic acid Openeye Name: 4-[benzyl(heptyl)amino]butanoic acid CAS Name: 4-[heptyl-(phenylmethyl)amino]butanoic acid IUPAC Name: 4-[benzyl(heptyl)amino]butanoic acid Traditional Name: 4-[benzyl(heptyl)amino]butyric acid Formula: C18H29NO2 MolecularWeight: 291.42836

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN(CCCC(=O)O)CC1=CC=CC=C1

Isomeric SMILES

CCCCCCCN(CCCC(=O)O)CC1=CC=CC=C1

InChI

InChI=1S/C18H29NO2/c1-2-3-4-5-9-14-19(15-10-13-18(20)21)16-17-11-7-6-8-12-17/h6-8,11-12H,2-5,9-10,13-16H2,1H3,(H,20,21)