ethyl 3-[[1-[(2-chlorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]methyl-methyl-carbamoyl]piperidine-1-carboxylate

Systemtic Name: ethyl 3-[[1-[(2-chlorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]methyl-methyl-carbamoyl]piperidine-1-carboxylate Openeye Name: ethyl 3-[[1-[(2-chlorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]methyl-methyl-carbamoyl]piperidine-1-carboxylate CAS Name: 3-[[[1-[(2-chlorophenyl)methyl]-3,5-dimethyl-4-pyrazolyl]methyl-methylamino]-oxomethyl]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[[1-[(2-chlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]methyl-methylcarbamoyl]piperidine-1-carboxylate Traditional Name: 3-[[1-(2-chlorobenzyl)-3,5-dimethyl-pyrazol-4-yl]methyl-methyl-carbamoyl]piperidine-1-carboxylic acid ethyl ester Formula: C23H31ClN4O3 MolecularWeight: 446.97024

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCCC(C1)C(=O)N(C)CC2=C(N(N=C2C)CC3=CC=CC=C3Cl)C

Isomeric SMILES

CCOC(=O)N1CCCC(C1)C(=O)N(C)CC2=C(N(N=C2C)CC3=CC=CC=C3Cl)C

InChI

InChI=1S/C23H31ClN4O3/c1-5-31-23(30)27-12-8-10-19(13-27)22(29)26(4)15-20-16(2)25-28(17(20)3)14-18-9-6-7-11-21(18)24/h6-7,9,11,19H,5,8,10,12-15H2,1-4H3