4-[7,8-dimethoxy-3-phenyl-1-(phenylmethyl)-2H-pyrazolo[3,4-c]isoquinolin-5-ylidene]-2-ethoxy-cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[7,8-dimethoxy-3-phenyl-1-(phenylmethyl)-2H-pyrazolo[3,4-c]isoquinolin-5-ylidene]-2-ethoxy-cyclohexa-2,5-dien-1-one Openeye Name: 4-(1-benzyl-7,8-dimethoxy-3-phenyl-2H-pyrazolo[3,4-c]isoquinolin-5-ylidene)-2-ethoxy-cyclohexa-2,5-dien-1-one CAS Name: 4-[7,8-dimethoxy-3-phenyl-1-(phenylmethyl)-2H-pyrazolo[3,4-c]isoquinolin-5-ylidene]-2-ethoxy-1-cyclohexa-2,5-dienone IUPAC Name: 4-(1-benzyl-7,8-dimethoxy-3-phenyl-2H-pyrazolo[3,4-c]isoquinolin-5-ylidene)-2-ethoxycyclohexa-2,5-dien-1-one Traditional Name: 4-(1-benzyl-7,8-dimethoxy-3-phenyl-2H-pyrazol[3,4-c]isoquinolin-5-ylidene)-2-ethoxy-cyclohexa-2,5-dien-1-one Formula: C33H29N3O4 MolecularWeight: 531.60106

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C2C3=CC(=C(C=C3C4=C(NN(C4=N2)C5=CC=CC=C5)CC6=CC=CC=C6)OC)OC)C=CC1=O

Isomeric SMILES

CCOC1=CC(=C2C3=CC(=C(C=C3C4=C(NN(C4=N2)C5=CC=CC=C5)CC6=CC=CC=C6)OC)OC)C=CC1=O

InChI

InChI=1S/C33H29N3O4/c1-4-40-28-18-22(15-16-27(28)37)32-25-20-30(39-3)29(38-2)19-24(25)31-26(17-21-11-7-5-8-12-21)35-36(33(31)34-32)23-13-9-6-10-14-23/h5-16,18-20,35H,4,17H2,1-3H3