(phenylmethyl) 9-(1,3-benzodioxol-5-ylcarbonyl)-8-phenoxy-1,2,3,4-tetrahydrocarbazole-4-carboxylate

Systemtic Name: (phenylmethyl) 9-(1,3-benzodioxol-5-ylcarbonyl)-8-phenoxy-1,2,3,4-tetrahydrocarbazole-4-carboxylate Openeye Name: benzyl 9-(1,3-benzodioxole-5-carbonyl)-8-phenoxy-1,2,3,4-tetrahydrocarbazole-4-carboxylate CAS Name: 9-[1,3-benzodioxol-5-yl(oxo)methyl]-8-phenoxy-1,2,3,4-tetrahydrocarbazole-4-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 9-(1,3-benzodioxole-5-carbonyl)-8-phenoxy-1,2,3,4-tetrahydrocarbazole-4-carboxylate Traditional Name: 8-phenoxy-9-piperonyloyl-1,2,3,4-tetrahydrocarbazole-4-carboxylic acid benzyl ester Formula: C34H27NO6 MolecularWeight: 545.58128

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C2=C(C1)N(C3=C2C=CC=C3OC4=CC=CC=C4)C(=O)C5=CC6=C(C=C5)OCO6)C(=O)OCC7=CC=CC=C7

Isomeric SMILES

C1CC(C2=C(C1)N(C3=C2C=CC=C3OC4=CC=CC=C4)C(=O)C5=CC6=C(C=C5)OCO6)C(=O)OCC7=CC=CC=C7

InChI

InChI=1S/C34H27NO6/c36-33(23-17-18-28-30(19-23)40-21-39-28)35-27-15-7-14-26(34(37)38-20-22-9-3-1-4-10-22)31(27)25-13-8-16-29(32(25)35)41-24-11-5-2-6-12-24/h1-6,8-13,16-19,26H,7,14-15,20-21H2