3-[[4-[2-(3,3-diphenylpropylamino)propyl]phenoxy]methyl]benzoic acid

Systemtic Name: 3-[[4-[2-(3,3-diphenylpropylamino)propyl]phenoxy]methyl]benzoic acid Openeye Name: 3-[[4-[2-(3,3-diphenylpropylamino)propyl]phenoxy]methyl]benzoic acid CAS Name: 3-[[4-[2-(3,3-diphenylpropylamino)propyl]phenoxy]methyl]benzoic acid IUPAC Name: 3-[[4-[2-(3,3-diphenylpropylamino)propyl]phenoxy]methyl]benzoic acid Traditional Name: 3-[[4-[2-(3,3-diphenylpropylamino)propyl]phenoxy]methyl]benzoic acid Formula: C32H33NO3 MolecularWeight: 479.60932

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=C(C=C1)OCC2=CC=CC(=C2)C(=O)O)NCCC(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(CC1=CC=C(C=C1)OCC2=CC=CC(=C2)C(=O)O)NCCC(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C32H33NO3/c1-24(33-20-19-31(27-10-4-2-5-11-27)28-12-6-3-7-13-28)21-25-15-17-30(18-16-25)36-23-26-9-8-14-29(22-26)32(34)35/h2-18,22,24,31,33H,19-21,23H2,1H3,(H,34,35)