[4-[[5-(4-chlorophenyl)-2-phenyl-pyrazol-3-yl]iminomethyl]-6-ethoxy-cyclohexa-1,2,3,5-tetraen-1-yl] 3-methoxybenzoate

Systemtic Name: [4-[[5-(4-chlorophenyl)-2-phenyl-pyrazol-3-yl]iminomethyl]-6-ethoxy-cyclohexa-1,2,3,5-tetraen-1-yl] 3-methoxybenzoate Openeye Name: [4-[[5-(4-chlorophenyl)-2-phenyl-pyrazol-3-yl]iminomethyl]-6-ethoxy-cyclohexa-1,2,3,5-tetraen-1-yl] 3-methoxybenzoate CAS Name: 3-methoxybenzoic acid [4-[[5-(4-chlorophenyl)-2-phenyl-3-pyrazolyl]iminomethyl]-6-ethoxy-1-cyclohexa-1,2,3,5-tetraenyl] ester IUPAC Name: [4-[[5-(4-chlorophenyl)-2-phenylpyrazol-3-yl]iminomethyl]-6-ethoxycyclohexa-1,2,3,5-tetraen-1-yl] 3-methoxybenzoate Traditional Name: 3-methoxybenzoic acid [4-[[5-(4-chlorophenyl)-2-phenyl-pyrazol-3-yl]iminomethyl]-6-ethoxy-cyclohexa-1,2,3,5-tetraen-1-yl] ester Formula: C32H24ClN3O4 MolecularWeight: 550.00366

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C=C=C1OC(=O)C2=CC(=CC=C2)OC)C=NC3=CC(=NN3C4=CC=CC=C4)C5=CC=C(C=C5)Cl

Isomeric SMILES

CCOC1=CC(=C=C=C1OC(=O)C2=CC(=CC=C2)OC)C=NC3=CC(=NN3C4=CC=CC=C4)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C32H24ClN3O4/c1-3-39-30-18-22(12-17-29(30)40-32(37)24-8-7-11-27(19-24)38-2)21-34-31-20-28(23-13-15-25(33)16-14-23)35-36(31)26-9-5-4-6-10-26/h4-11,13-16,18-21H,3H2,1-2H3