[4-[bis(5-methyl-3-oxidanylidene-2-phenyl-1H-pyrazol-4-yl)methyl]-2-methoxy-phenyl] 2-methoxybenzoate

Systemtic Name: [4-[bis(5-methyl-3-oxidanylidene-2-phenyl-1H-pyrazol-4-yl)methyl]-2-methoxy-phenyl] 2-methoxybenzoate Openeye Name: [4-[bis(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)methyl]-2-methoxy-phenyl] 2-methoxybenzoate CAS Name: 2-methoxybenzoic acid [4-[bis(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)methyl]-2-methoxyphenyl] ester IUPAC Name: [4-[bis(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)methyl]-2-methoxyphenyl] 2-methoxybenzoate Traditional Name: 2-methoxybenzoic acid [4-[bis(5-keto-3-methyl-1-phenyl-3-pyrazolin-4-yl)methyl]-2-methoxy-phenyl] ester Formula: C36H32N4O6 MolecularWeight: 616.66248

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1)C2=CC=CC=C2)C(C3=CC(=C(C=C3)OC(=O)C4=CC=CC=C4OC)OC)C5=C(NN(C5=O)C6=CC=CC=C6)C

Isomeric SMILES

CC1=C(C(=O)N(N1)C2=CC=CC=C2)C(C3=CC(=C(C=C3)OC(=O)C4=CC=CC=C4OC)OC)C5=C(NN(C5=O)C6=CC=CC=C6)C

InChI

InChI=1S/C36H32N4O6/c1-22-31(34(41)39(37-22)25-13-7-5-8-14-25)33(32-23(2)38-40(35(32)42)26-15-9-6-10-16-26)24-19-20-29(30(21-24)45-4)46-36(43)27-17-11-12-18-28(27)44-3/h5-21,33,37-38H,1-4H3