(4-chlorophenyl)methyl 6-tert-butyl-9-(4-hexoxyphenyl)carbonyl-1,2,3,4-tetrahydrocarbazole-4-carboxylate

Systemtic Name: (4-chlorophenyl)methyl 6-tert-butyl-9-(4-hexoxyphenyl)carbonyl-1,2,3,4-tetrahydrocarbazole-4-carboxylate Openeye Name: (4-chlorophenyl)methyl 6-tert-butyl-9-(4-hexoxybenzoyl)-1,2,3,4-tetrahydrocarbazole-4-carboxylate CAS Name: 6-tert-butyl-9-[(4-hexoxyphenyl)-oxomethyl]-1,2,3,4-tetrahydrocarbazole-4-carboxylic acid (4-chlorophenyl)methyl ester IUPAC Name: (4-chlorophenyl)methyl 6-tert-butyl-9-(4-hexoxybenzoyl)-1,2,3,4-tetrahydrocarbazole-4-carboxylate Traditional Name: 6-tert-butyl-9-(4-hexoxybenzoyl)-1,2,3,4-tetrahydrocarbazole-4-carboxylic acid (4-chlorobenzyl) ester Formula: C37H42ClNO4 MolecularWeight: 600.18668

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C(=O)N2C3=C(C(CCC3)C(=O)OCC4=CC=C(C=C4)Cl)C5=C2C=CC(=C5)C(C)(C)C

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C(=O)N2C3=C(C(CCC3)C(=O)OCC4=CC=C(C=C4)Cl)C5=C2C=CC(=C5)C(C)(C)C

InChI

InChI=1S/C37H42ClNO4/c1-5-6-7-8-22-42-29-19-14-26(15-20-29)35(40)39-32-21-16-27(37(2,3)4)23-31(32)34-30(10-9-11-33(34)39)36(41)43-24-25-12-17-28(38)18-13-25/h12-21,23,30H,5-11,22,24H2,1-4H3