ethyl 1-[4-[[4-(4-ethoxycarbonyl-5-methyl-pyrazol-1-yl)phenyl]methyl]phenyl]-5-methyl-pyrazole-4-carboxylate

Systemtic Name: ethyl 1-[4-[[4-(4-ethoxycarbonyl-5-methyl-pyrazol-1-yl)phenyl]methyl]phenyl]-5-methyl-pyrazole-4-carboxylate Openeye Name: ethyl 1-[4-[[4-(4-ethoxycarbonyl-5-methyl-pyrazol-1-yl)phenyl]methyl]phenyl]-5-methyl-pyrazole-4-carboxylate CAS Name: 1-[4-[[4-(4-ethoxycarbonyl-5-methyl-1-pyrazolyl)phenyl]methyl]phenyl]-5-methyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[4-[[4-(4-ethoxycarbonyl-5-methylpyrazol-1-yl)phenyl]methyl]phenyl]-5-methylpyrazole-4-carboxylate Traditional Name: 1-[4-[4-(4-carbethoxy-5-methyl-pyrazol-1-yl)benzyl]phenyl]-5-methyl-pyrazole-4-carboxylic acid ethyl ester Formula: C27H28N4O4 MolecularWeight: 472.53562

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)CC3=CC=C(C=C3)N4C(=C(C=N4)C(=O)OCC)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)CC3=CC=C(C=C3)N4C(=C(C=N4)C(=O)OCC)C)C

InChI

InChI=1S/C27H28N4O4/c1-5-34-26(32)24-16-28-30(18(24)3)22-11-7-20(8-12-22)15-21-9-13-23(14-10-21)31-19(4)25(17-29-31)27(33)35-6-2/h7-14,16-17H,5-6,15H2,1-4H3