8-[4-[2-[methyl(1-phenylethyl)amino]-2-oxidanylidene-ethyl]phenyl]-7-phenyl-octanoic acid

Systemtic Name: 8-[4-[2-[methyl(1-phenylethyl)amino]-2-oxidanylidene-ethyl]phenyl]-7-phenyl-octanoic acid Openeye Name: 8-[4-[2-[methyl(1-phenylethyl)amino]-2-oxo-ethyl]phenyl]-7-phenyl-octanoic acid CAS Name: 8-[4-[2-[methyl(1-phenylethyl)amino]-2-oxoethyl]phenyl]-7-phenyloctanoic acid IUPAC Name: 8-[4-[2-[methyl(1-phenylethyl)amino]-2-oxoethyl]phenyl]-7-phenyloctanoic acid Traditional Name: 8-[4-[2-keto-2-[methyl(1-phenylethyl)amino]ethyl]phenyl]-7-phenyl-caprylic acid Formula: C31H37NO3 MolecularWeight: 471.63038

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N(C)C(=O)CC2=CC=C(C=C2)CC(CCCCCC(=O)O)C3=CC=CC=C3

Isomeric SMILES

CC(C1=CC=CC=C1)N(C)C(=O)CC2=CC=C(C=C2)CC(CCCCCC(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C31H37NO3/c1-24(27-12-6-3-7-13-27)32(2)30(33)23-26-20-18-25(19-21-26)22-29(28-14-8-4-9-15-28)16-10-5-11-17-31(34)35/h3-4,6-9,12-15,18-21,24,29H,5,10-11,16-17,22-23H2,1-2H3,(H,34,35)