2-[2-[[3-phenylpropanoyl(3-phenylpropyl)amino]methyl]phenyl]benzoic acid

Systemtic Name: 2-[2-[[3-phenylpropanoyl(3-phenylpropyl)amino]methyl]phenyl]benzoic acid Openeye Name: 2-[2-[[3-phenylpropanoyl(3-phenylpropyl)amino]methyl]phenyl]benzoic acid CAS Name: 2-[2-[[(1-oxo-3-phenylpropyl)-(3-phenylpropyl)amino]methyl]phenyl]benzoic acid IUPAC Name: 2-[2-[[3-phenylpropanoyl(3-phenylpropyl)amino]methyl]phenyl]benzoic acid Traditional Name: 2-[2-[[hydrocinnamoyl(3-phenylpropyl)amino]methyl]phenyl]benzoic acid Formula: C32H31NO3 MolecularWeight: 477.59344

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCN(CC2=CC=CC=C2C3=CC=CC=C3C(=O)O)C(=O)CCC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CCCN(CC2=CC=CC=C2C3=CC=CC=C3C(=O)O)C(=O)CCC4=CC=CC=C4

InChI

InChI=1S/C32H31NO3/c34-31(22-21-26-14-5-2-6-15-26)33(23-11-16-25-12-3-1-4-13-25)24-27-17-7-8-18-28(27)29-19-9-10-20-30(29)32(35)36/h1-10,12-15,17-20H,11,16,21-24H2,(H,35,36)