4-[[butyl(furan-2-ylmethyl)amino]methyl]-2-(2-methylphenyl)benzoic acid

Systemtic Name: 4-[[butyl(furan-2-ylmethyl)amino]methyl]-2-(2-methylphenyl)benzoic acid Openeye Name: 4-[[butyl(2-furylmethyl)amino]methyl]-2-(o-tolyl)benzoic acid CAS Name: 4-[[butyl(2-furanylmethyl)amino]methyl]-2-(2-methylphenyl)benzoic acid IUPAC Name: 4-[[butyl(furan-2-ylmethyl)amino]methyl]-2-(2-methylphenyl)benzoic acid Traditional Name: 4-[[butyl(2-furfuryl)amino]methyl]-2-(o-tolyl)benzoic acid Formula: C24H27NO3 MolecularWeight: 377.47608

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=CC(=C(C=C1)C(=O)O)C2=CC=CC=C2C)CC3=CC=CO3

Isomeric SMILES

CCCCN(CC1=CC(=C(C=C1)C(=O)O)C2=CC=CC=C2C)CC3=CC=CO3

InChI

InChI=1S/C24H27NO3/c1-3-4-13-25(17-20-9-7-14-28-20)16-19-11-12-22(24(26)27)23(15-19)21-10-6-5-8-18(21)2/h5-12,14-15H,3-4,13,16-17H2,1-2H3,(H,26,27)