ethyl 5-methyl-1-[4-[4-(phenylcarbamoyl)piperidin-1-yl]carbonylphenyl]pyrazole-4-carboxylate

Systemtic Name: ethyl 5-methyl-1-[4-[4-(phenylcarbamoyl)piperidin-1-yl]carbonylphenyl]pyrazole-4-carboxylate Openeye Name: ethyl 5-methyl-1-[4-[4-(phenylcarbamoyl)piperidine-1-carbonyl]phenyl]pyrazole-4-carboxylate CAS Name: 1-[4-[[4-[anilino(oxo)methyl]-1-piperidinyl]-oxomethyl]phenyl]-5-methyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-1-[4-[4-(phenylcarbamoyl)piperidine-1-carbonyl]phenyl]pyrazole-4-carboxylate Traditional Name: 5-methyl-1-[4-[4-(phenylcarbamoyl)piperidine-1-carbonyl]phenyl]pyrazole-4-carboxylic acid ethyl ester Formula: C26H28N4O4 MolecularWeight: 460.52492

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C(=O)N3CCC(CC3)C(=O)NC4=CC=CC=C4)C

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C(=O)N3CCC(CC3)C(=O)NC4=CC=CC=C4)C

InChI

InChI=1S/C26H28N4O4/c1-3-34-26(33)23-17-27-30(18(23)2)22-11-9-20(10-12-22)25(32)29-15-13-19(14-16-29)24(31)28-21-7-5-4-6-8-21/h4-12,17,19H,3,13-16H2,1-2H3,(H,28,31)