ethyl 5-methyl-1-[4-[4-(4-nitrophenyl)piperazin-1-yl]carbonylphenyl]pyrazole-4-carboxylate

Systemtic Name: ethyl 5-methyl-1-[4-[4-(4-nitrophenyl)piperazin-1-yl]carbonylphenyl]pyrazole-4-carboxylate Openeye Name: ethyl 5-methyl-1-[4-[4-(4-nitrophenyl)piperazine-1-carbonyl]phenyl]pyrazole-4-carboxylate CAS Name: 5-methyl-1-[4-[[4-(4-nitrophenyl)-1-piperazinyl]-oxomethyl]phenyl]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-1-[4-[4-(4-nitrophenyl)piperazine-1-carbonyl]phenyl]pyrazole-4-carboxylate Traditional Name: 5-methyl-1-[4-[4-(4-nitrophenyl)piperazine-1-carbonyl]phenyl]pyrazole-4-carboxylic acid ethyl ester Formula: C24H25N5O5 MolecularWeight: 463.4858

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-])C

InChI

InChI=1S/C24H25N5O5/c1-3-34-24(31)22-16-25-28(17(22)2)20-6-4-18(5-7-20)23(30)27-14-12-26(13-15-27)19-8-10-21(11-9-19)29(32)33/h4-11,16H,3,12-15H2,1-2H3