tert-butyl 4-[4-[(3-chloranyl-4-methoxy-phenyl)carbamoyl]-2-(4-propan-2-ylphenyl)pyrazol-3-yl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-[(3-chloranyl-4-methoxy-phenyl)carbamoyl]-2-(4-propan-2-ylphenyl)pyrazol-3-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[4-[(3-chloro-4-methoxy-phenyl)carbamoyl]-2-(4-isopropylphenyl)pyrazol-3-yl]piperidine-1-carboxylate CAS Name: 4-[4-[(3-chloro-4-methoxyanilino)-oxomethyl]-2-(4-propan-2-ylphenyl)-3-pyrazolyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-[(3-chloro-4-methoxyphenyl)carbamoyl]-2-(4-propan-2-ylphenyl)pyrazol-3-yl]piperidine-1-carboxylate Traditional Name: 4-[4-[(3-chloro-4-methoxy-phenyl)carbamoyl]-2-p-cumenyl-pyrazol-3-yl]piperidine-1-carboxylic acid tert-butyl ester Formula: C30H37ClN4O4 MolecularWeight: 553.09218

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)N2C(=C(C=N2)C(=O)NC3=CC(=C(C=C3)OC)Cl)C4CCN(CC4)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)N2C(=C(C=N2)C(=O)NC3=CC(=C(C=C3)OC)Cl)C4CCN(CC4)C(=O)OC(C)(C)C

InChI

InChI=1S/C30H37ClN4O4/c1-19(2)20-7-10-23(11-8-20)35-27(21-13-15-34(16-14-21)29(37)39-30(3,4)5)24(18-32-35)28(36)33-22-9-12-26(38-6)25(31)17-22/h7-12,17-19,21H,13-16H2,1-6H3,(H,33,36)