2-[4-[4-(diphenylamino)piperidin-1-yl]-4-methyl-piperidin-1-yl]carbonylbenzoic acid

Systemtic Name: 2-[4-[4-(diphenylamino)piperidin-1-yl]-4-methyl-piperidin-1-yl]carbonylbenzoic acid Openeye Name: 2-[4-methyl-4-[4-(N-phenylanilino)-1-piperidyl]piperidine-1-carbonyl]benzoic acid CAS Name: 2-[[4-methyl-4-[4-(N-phenylanilino)-1-piperidinyl]-1-piperidinyl]-oxomethyl]benzoic acid IUPAC Name: 2-[4-methyl-4-[4-(N-phenylanilino)piperidin-1-yl]piperidine-1-carbonyl]benzoic acid Traditional Name: 2-[4-methyl-4-[4-(N-phenylanilino)piperidino]piperidine-1-carbonyl]benzoic acid Formula: C31H35N3O3 MolecularWeight: 497.6279

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCN(CC1)C(=O)C2=CC=CC=C2C(=O)O)N3CCC(CC3)N(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1(CCN(CC1)C(=O)C2=CC=CC=C2C(=O)O)N3CCC(CC3)N(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C31H35N3O3/c1-31(18-22-32(23-19-31)29(35)27-14-8-9-15-28(27)30(36)37)33-20-16-26(17-21-33)34(24-10-4-2-5-11-24)25-12-6-3-7-13-25/h2-15,26H,16-23H2,1H3,(H,36,37)