(phenylmethyl) 7-methoxy-6-(6-phenylhexoxy)-2,3,4,9-tetrahydro-1H-carbazole-3-carboxylate

Systemtic Name: (phenylmethyl) 7-methoxy-6-(6-phenylhexoxy)-2,3,4,9-tetrahydro-1H-carbazole-3-carboxylate Openeye Name: benzyl 7-methoxy-6-(6-phenylhexoxy)-2,3,4,9-tetrahydro-1H-carbazole-3-carboxylate CAS Name: 7-methoxy-6-(6-phenylhexoxy)-2,3,4,9-tetrahydro-1H-carbazole-3-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 7-methoxy-6-(6-phenylhexoxy)-2,3,4,9-tetrahydro-1H-carbazole-3-carboxylate Traditional Name: 7-methoxy-6-(6-phenylhexoxy)-2,3,4,9-tetrahydro-1H-carbazole-3-carboxylic acid benzyl ester Formula: C33H37NO4 MolecularWeight: 511.65118

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C3=C(CCC(C3)C(=O)OCC4=CC=CC=C4)NC2=C1)OCCCCCCC5=CC=CC=C5

Isomeric SMILES

COC1=C(C=C2C3=C(CCC(C3)C(=O)OCC4=CC=CC=C4)NC2=C1)OCCCCCCC5=CC=CC=C5

InChI

InChI=1S/C33H37NO4/c1-36-31-22-30-28(21-32(31)37-19-11-3-2-6-12-24-13-7-4-8-14-24)27-20-26(17-18-29(27)34-30)33(35)38-23-25-15-9-5-10-16-25/h4-5,7-10,13-16,21-22,26,34H,2-3,6,11-12,17-20,23H2,1H3