ethyl 5-[(4-aminocarbonyl-4-piperidin-1-yl-piperidin-1-yl)methyl]-1-(2,3-dimethylphenyl)pyrazole-4-carboxylate

Systemtic Name: ethyl 5-[(4-aminocarbonyl-4-piperidin-1-yl-piperidin-1-yl)methyl]-1-(2,3-dimethylphenyl)pyrazole-4-carboxylate Openeye Name: ethyl 5-[[4-carbamoyl-4-(1-piperidyl)-1-piperidyl]methyl]-1-(2,3-dimethylphenyl)pyrazole-4-carboxylate CAS Name: 5-[[4-carbamoyl-4-(1-piperidinyl)-1-piperidinyl]methyl]-1-(2,3-dimethylphenyl)-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(4-carbamoyl-4-piperidin-1-ylpiperidin-1-yl)methyl]-1-(2,3-dimethylphenyl)pyrazole-4-carboxylate Traditional Name: 5-[(4-carbamoyl-4-piperidino-piperidino)methyl]-1-(2,3-dimethylphenyl)pyrazole-4-carboxylic acid ethyl ester Formula: C26H37N5O3 MolecularWeight: 467.60368

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC=CC(=C2C)C)CN3CCC(CC3)(C(=O)N)N4CCCCC4

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=CC(=C2C)C)CN3CCC(CC3)(C(=O)N)N4CCCCC4

InChI

InChI=1S/C26H37N5O3/c1-4-34-24(32)21-17-28-31(22-10-8-9-19(2)20(22)3)23(21)18-29-15-11-26(12-16-29,25(27)33)30-13-6-5-7-14-30/h8-10,17H,4-7,11-16,18H2,1-3H3,(H2,27,33)