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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)NC3=C2C(CCC3)C(=O)OCC4=CC=CC=C4)OCCCCCCC5=CC=CC=C5

Isomeric SMILES

COC1=C(C=C2C(=C1)NC3=C2C(CCC3)C(=O)OCC4=CC=CC=C4)OCCCCCCC5=CC=CC=C5

InChI

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