ethyl 1-[5-chloranyl-1-[(2-chlorophenyl)methyl]-3-methyl-pyrazol-4-yl]carbonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-[5-chloranyl-1-[(2-chlorophenyl)methyl]-3-methyl-pyrazol-4-yl]carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-[5-chloro-1-[(2-chlorophenyl)methyl]-3-methyl-pyrazole-4-carbonyl]piperidine-4-carboxylate CAS Name: 1-[[5-chloro-1-[(2-chlorophenyl)methyl]-3-methyl-4-pyrazolyl]-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[5-chloro-1-[(2-chlorophenyl)methyl]-3-methylpyrazole-4-carbonyl]piperidine-4-carboxylate Traditional Name: 1-[5-chloro-1-(2-chlorobenzyl)-3-methyl-pyrazole-4-carbonyl]isonipecotic acid ethyl ester Formula: C20H23Cl2N3O3 MolecularWeight: 424.32092

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C2=C(N(N=C2C)CC3=CC=CC=C3Cl)Cl

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C2=C(N(N=C2C)CC3=CC=CC=C3Cl)Cl

InChI

InChI=1S/C20H23Cl2N3O3/c1-3-28-20(27)14-8-10-24(11-9-14)19(26)17-13(2)23-25(18(17)22)12-15-6-4-5-7-16(15)21/h4-7,14H,3,8-12H2,1-2H3