methyl 8-[(3-bromophenyl)methyl]-5-oxidanylidene-7-pentyl-6,7,8,9-tetrahydrocarbazole-4-carboxylate

Systemtic Name: methyl 8-[(3-bromophenyl)methyl]-5-oxidanylidene-7-pentyl-6,7,8,9-tetrahydrocarbazole-4-carboxylate Openeye Name: methyl 8-[(3-bromophenyl)methyl]-5-oxo-7-pentyl-6,7,8,9-tetrahydrocarbazole-4-carboxylate CAS Name: 8-[(3-bromophenyl)methyl]-5-oxo-7-pentyl-6,7,8,9-tetrahydrocarbazole-4-carboxylic acid methyl ester IUPAC Name: methyl 8-[(3-bromophenyl)methyl]-5-oxo-7-pentyl-6,7,8,9-tetrahydrocarbazole-4-carboxylate Traditional Name: 7-amyl-8-(3-bromobenzyl)-5-keto-6,7,8,9-tetrahydrocarbazole-4-carboxylic acid methyl ester Formula: C26H28BrNO3 MolecularWeight: 482.40942

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CC(=O)C2=C(C1CC3=CC(=CC=C3)Br)NC4=CC=CC(=C42)C(=O)OC

Isomeric SMILES

CCCCCC1CC(=O)C2=C(C1CC3=CC(=CC=C3)Br)NC4=CC=CC(=C42)C(=O)OC

InChI

InChI=1S/C26H28BrNO3/c1-3-4-5-9-17-15-22(29)24-23-19(26(30)31-2)11-7-12-21(23)28-25(24)20(17)14-16-8-6-10-18(27)13-16/h6-8,10-13,17,20,28H,3-5,9,14-15H2,1-2H3