ethyl 5-azanyl-1-[4-(4-piperidin-1-ylpiperidin-1-yl)carbonylphenyl]pyrazole-4-carboxylate

Systemtic Name: ethyl 5-azanyl-1-[4-(4-piperidin-1-ylpiperidin-1-yl)carbonylphenyl]pyrazole-4-carboxylate Openeye Name: ethyl 5-amino-1-[4-[4-(1-piperidyl)piperidine-1-carbonyl]phenyl]pyrazole-4-carboxylate CAS Name: 5-amino-1-[4-[oxo-[4-(1-piperidinyl)-1-piperidinyl]methyl]phenyl]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-1-[4-(4-piperidin-1-ylpiperidine-1-carbonyl)phenyl]pyrazole-4-carboxylate Traditional Name: 5-amino-1-[4-(4-piperidinopiperidine-1-carbonyl)phenyl]pyrazole-4-carboxylic acid ethyl ester Formula: C23H31N5O3 MolecularWeight: 425.52394

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C(=O)N3CCC(CC3)N4CCCCC4)N

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C(=O)N3CCC(CC3)N4CCCCC4)N

InChI

InChI=1S/C23H31N5O3/c1-2-31-23(30)20-16-25-28(21(20)24)19-8-6-17(7-9-19)22(29)27-14-10-18(11-15-27)26-12-4-3-5-13-26/h6-9,16,18H,2-5,10-15,24H2,1H3