methyl 9-[(2-methylphenyl)methyl]-5-oxidanyl-7-pentyl-carbazole-4-carboxylate

Systemtic Name: methyl 9-[(2-methylphenyl)methyl]-5-oxidanyl-7-pentyl-carbazole-4-carboxylate Openeye Name: methyl 5-hydroxy-9-(o-tolylmethyl)-7-pentyl-carbazole-4-carboxylate CAS Name: 5-hydroxy-9-[(2-methylphenyl)methyl]-7-pentyl-4-carbazolecarboxylic acid methyl ester IUPAC Name: methyl 5-hydroxy-9-[(2-methylphenyl)methyl]-7-pentylcarbazole-4-carboxylate Traditional Name: 7-amyl-5-hydroxy-9-(2-methylbenzyl)carbazole-4-carboxylic acid methyl ester Formula: C27H29NO3 MolecularWeight: 415.52406

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC2=C(C(=C1)O)C3=C(C=CC=C3N2CC4=CC=CC=C4C)C(=O)OC

Isomeric SMILES

CCCCCC1=CC2=C(C(=C1)O)C3=C(C=CC=C3N2CC4=CC=CC=C4C)C(=O)OC

InChI

InChI=1S/C27H29NO3/c1-4-5-6-11-19-15-23-26(24(29)16-19)25-21(27(30)31-3)13-9-14-22(25)28(23)17-20-12-8-7-10-18(20)2/h7-10,12-16,29H,4-6,11,17H2,1-3H3