ethyl 5-methyl-1-[4-[3-(4-methylpiperidin-1-yl)propylcarbamoyl]phenyl]pyrazole-4-carboxylate

Systemtic Name: ethyl 5-methyl-1-[4-[3-(4-methylpiperidin-1-yl)propylcarbamoyl]phenyl]pyrazole-4-carboxylate Openeye Name: ethyl 5-methyl-1-[4-[3-(4-methyl-1-piperidyl)propylcarbamoyl]phenyl]pyrazole-4-carboxylate CAS Name: 5-methyl-1-[4-[[3-(4-methyl-1-piperidinyl)propylamino]-oxomethyl]phenyl]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-1-[4-[3-(4-methylpiperidin-1-yl)propylcarbamoyl]phenyl]pyrazole-4-carboxylate Traditional Name: 5-methyl-1-[4-[3-(4-methylpiperidino)propylcarbamoyl]phenyl]pyrazole-4-carboxylic acid ethyl ester Formula: C23H32N4O3 MolecularWeight: 412.52518

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C(=O)NCCCN3CCC(CC3)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C(=O)NCCCN3CCC(CC3)C)C

InChI

InChI=1S/C23H32N4O3/c1-4-30-23(29)21-16-25-27(18(21)3)20-8-6-19(7-9-20)22(28)24-12-5-13-26-14-10-17(2)11-15-26/h6-9,16-17H,4-5,10-15H2,1-3H3,(H,24,28)