methyl 9-[(3-cyanophenyl)methyl]-5-oxidanylidene-7-pentyl-7,8-dihydro-6H-carbazole-4-carboxylate

Systemtic Name: methyl 9-[(3-cyanophenyl)methyl]-5-oxidanylidene-7-pentyl-7,8-dihydro-6H-carbazole-4-carboxylate Openeye Name: methyl 9-[(3-cyanophenyl)methyl]-5-oxo-7-pentyl-7,8-dihydro-6H-carbazole-4-carboxylate CAS Name: 9-[(3-cyanophenyl)methyl]-5-oxo-7-pentyl-7,8-dihydro-6H-carbazole-4-carboxylic acid methyl ester IUPAC Name: methyl 9-[(3-cyanophenyl)methyl]-5-oxo-7-pentyl-7,8-dihydro-6H-carbazole-4-carboxylate Traditional Name: 7-amyl-9-(3-cyanobenzyl)-5-keto-7,8-dihydro-6H-carbazole-4-carboxylic acid methyl ester Formula: C27H28N2O3 MolecularWeight: 428.52282

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CC2=C(C(=O)C1)C3=C(C=CC=C3N2CC4=CC=CC(=C4)C#N)C(=O)OC

Isomeric SMILES

CCCCCC1CC2=C(C(=O)C1)C3=C(C=CC=C3N2CC4=CC=CC(=C4)C#N)C(=O)OC

InChI

InChI=1S/C27H28N2O3/c1-3-4-5-8-18-14-23-26(24(30)15-18)25-21(27(31)32-2)11-7-12-22(25)29(23)17-20-10-6-9-19(13-20)16-28/h6-7,9-13,18H,3-5,8,14-15,17H2,1-2H3