4-[(3-methyl-1-phenyl-butyl)amino]benzoic acid

Systemtic Name: 4-[(3-methyl-1-phenyl-butyl)amino]benzoic acid Openeye Name: 4-[(3-methyl-1-phenyl-butyl)amino]benzoic acid CAS Name: 4-[(3-methyl-1-phenylbutyl)amino]benzoic acid IUPAC Name: 4-[(3-methyl-1-phenylbutyl)amino]benzoic acid Traditional Name: 4-[(3-methyl-1-phenyl-butyl)amino]benzoic acid Formula: C18H21NO2 MolecularWeight: 283.36484

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=CC=CC=C1)NC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CC(C)CC(C1=CC=CC=C1)NC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C18H21NO2/c1-13(2)12-17(14-6-4-3-5-7-14)19-16-10-8-15(9-11-16)18(20)21/h3-11,13,17,19H,12H2,1-2H3,(H,20,21)