(phenylmethyl) 6-(dimethylamino)-9-(phenylcarbonyl)-1,2,3,4-tetrahydrocarbazole-3-carboxylate

Systemtic Name: (phenylmethyl) 6-(dimethylamino)-9-(phenylcarbonyl)-1,2,3,4-tetrahydrocarbazole-3-carboxylate Openeye Name: benzyl 9-benzoyl-6-(dimethylamino)-1,2,3,4-tetrahydrocarbazole-3-carboxylate CAS Name: 9-benzoyl-6-(dimethylamino)-1,2,3,4-tetrahydrocarbazole-3-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 9-benzoyl-6-(dimethylamino)-1,2,3,4-tetrahydrocarbazole-3-carboxylate Traditional Name: 9-benzoyl-6-(dimethylamino)-1,2,3,4-tetrahydrocarbazole-3-carboxylic acid benzyl ester Formula: C29H28N2O3 MolecularWeight: 452.54422

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC2=C(C=C1)N(C3=C2CC(CC3)C(=O)OCC4=CC=CC=C4)C(=O)C5=CC=CC=C5

Isomeric SMILES

CN(C)C1=CC2=C(C=C1)N(C3=C2CC(CC3)C(=O)OCC4=CC=CC=C4)C(=O)C5=CC=CC=C5

InChI

InChI=1S/C29H28N2O3/c1-30(2)23-14-16-27-25(18-23)24-17-22(29(33)34-19-20-9-5-3-6-10-20)13-15-26(24)31(27)28(32)21-11-7-4-8-12-21/h3-12,14,16,18,22H,13,15,17,19H2,1-2H3