ethyl 1-[4-[4-(2-ethoxyphenyl)piperazin-1-yl]carbonylphenyl]-5-methyl-pyrazole-4-carboxylate

Systemtic Name: ethyl 1-[4-[4-(2-ethoxyphenyl)piperazin-1-yl]carbonylphenyl]-5-methyl-pyrazole-4-carboxylate Openeye Name: ethyl 1-[4-[4-(2-ethoxyphenyl)piperazine-1-carbonyl]phenyl]-5-methyl-pyrazole-4-carboxylate CAS Name: 1-[4-[[4-(2-ethoxyphenyl)-1-piperazinyl]-oxomethyl]phenyl]-5-methyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[4-[4-(2-ethoxyphenyl)piperazine-1-carbonyl]phenyl]-5-methylpyrazole-4-carboxylate Traditional Name: 5-methyl-1-[4-(4-o-phenetylpiperazine-1-carbonyl)phenyl]pyrazole-4-carboxylic acid ethyl ester Formula: C26H30N4O4 MolecularWeight: 462.5408

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2CCN(CC2)C(=O)C3=CC=C(C=C3)N4C(=C(C=N4)C(=O)OCC)C

Isomeric SMILES

CCOC1=CC=CC=C1N2CCN(CC2)C(=O)C3=CC=C(C=C3)N4C(=C(C=N4)C(=O)OCC)C

InChI

InChI=1S/C26H30N4O4/c1-4-33-24-9-7-6-8-23(24)28-14-16-29(17-15-28)25(31)20-10-12-21(13-11-20)30-19(3)22(18-27-30)26(32)34-5-2/h6-13,18H,4-5,14-17H2,1-3H3