1-[4-aminocarbonyl-1-(2-chloranyl-3-methyl-phenyl)-5-(4-chlorophenyl)pyrazol-3-yl]carbonyl-4-phenyl-piperidine-4-carboxylic acid

Systemtic Name: 1-[4-aminocarbonyl-1-(2-chloranyl-3-methyl-phenyl)-5-(4-chlorophenyl)pyrazol-3-yl]carbonyl-4-phenyl-piperidine-4-carboxylic acid Openeye Name: 1-[4-carbamoyl-1-(2-chloro-3-methyl-phenyl)-5-(4-chlorophenyl)pyrazole-3-carbonyl]-4-phenyl-piperidine-4-carboxylic acid CAS Name: 1-[[4-carbamoyl-1-(2-chloro-3-methylphenyl)-5-(4-chlorophenyl)-3-pyrazolyl]-oxomethyl]-4-phenyl-4-piperidinecarboxylic acid IUPAC Name: 1-[4-carbamoyl-1-(2-chloro-3-methylphenyl)-5-(4-chlorophenyl)pyrazole-3-carbonyl]-4-phenylpiperidine-4-carboxylic acid Traditional Name: 1-[4-carbamoyl-1-(2-chloro-3-methyl-phenyl)-5-(4-chlorophenyl)pyrazole-3-carbonyl]-4-phenyl-isonipecotic acid Formula: C30H26Cl2N4O4 MolecularWeight: 577.45784

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2C(=C(C(=N2)C(=O)N3CCC(CC3)(C4=CC=CC=C4)C(=O)O)C(=O)N)C5=CC=C(C=C5)Cl)Cl

Isomeric SMILES

CC1=C(C(=CC=C1)N2C(=C(C(=N2)C(=O)N3CCC(CC3)(C4=CC=CC=C4)C(=O)O)C(=O)N)C5=CC=C(C=C5)Cl)Cl

InChI

InChI=1S/C30H26Cl2N4O4/c1-18-6-5-9-22(24(18)32)36-26(19-10-12-21(31)13-11-19)23(27(33)37)25(34-36)28(38)35-16-14-30(15-17-35,29(39)40)20-7-3-2-4-8-20/h2-13H,14-17H2,1H3,(H2,33,37)(H,39,40)