2-[(4-pentylphenyl)methylamino]-2-phenyl-propanoic acid

Systemtic Name: 2-[(4-pentylphenyl)methylamino]-2-phenyl-propanoic acid Openeye Name: 2-[(4-pentylphenyl)methylamino]-2-phenyl-propanoic acid CAS Name: 2-[(4-pentylphenyl)methylamino]-2-phenylpropanoic acid IUPAC Name: 2-[(4-pentylphenyl)methylamino]-2-phenylpropanoic acid Traditional Name: 2-[(4-amylbenzyl)amino]-2-phenyl-propionic acid Formula: C21H27NO2 MolecularWeight: 325.44458

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)CNC(C)(C2=CC=CC=C2)C(=O)O

Isomeric SMILES

CCCCCC1=CC=C(C=C1)CNC(C)(C2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C21H27NO2/c1-3-4-6-9-17-12-14-18(15-13-17)16-22-21(2,20(23)24)19-10-7-5-8-11-19/h5,7-8,10-15,22H,3-4,6,9,16H2,1-2H3,(H,23,24)