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

Systemtic Name: ethyl 5-methyl-1-[4-[4-(methylcarbamoyl)piperidin-1-yl]carbonylphenyl]pyrazole-4-carboxylate Openeye Name: ethyl 5-methyl-1-[4-[4-(methylcarbamoyl)piperidine-1-carbonyl]phenyl]pyrazole-4-carboxylate CAS Name: 5-methyl-1-[4-[[4-(methylcarbamoyl)-1-piperidinyl]-oxomethyl]phenyl]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-1-[4-[4-(methylcarbamoyl)piperidine-1-carbonyl]phenyl]pyrazole-4-carboxylate Traditional Name: 5-methyl-1-[4-[4-(methylcarbamoyl)piperidine-1-carbonyl]phenyl]pyrazole-4-carboxylic acid ethyl ester Formula: C21H26N4O4 MolecularWeight: 398.45554

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N4O4/c1-4-29-21(28)18-13-23-25(14(18)2)17-7-5-16(6-8-17)20(27)24-11-9-15(10-12-24)19(26)22-3/h5-8,13,15H,4,9-12H2,1-3H3,(H,22,26)