[(E)-heptadec-8-enyl] 2,5,11-trimethylpyrido[4,3-b]carbazole-9-carboxylate

Systemtic Name: [(E)-heptadec-8-enyl] 2,5,11-trimethylpyrido[4,3-b]carbazole-9-carboxylate Openeye Name: [(E)-heptadec-8-enyl] 2,5,11-trimethylpyrido[4,3-b]carbazole-9-carboxylate CAS Name: 2,5,11-trimethyl-9-pyrido[4,3-b]carbazolecarboxylic acid [(E)-heptadec-8-enyl] ester IUPAC Name: [(E)-heptadec-8-enyl] 2,5,11-trimethylpyrido[4,3-b]carbazole-9-carboxylate Traditional Name: 2,5,11-trimethylpyrido[4,3-b]carbazole-9-carboxylic acid [(E)-heptadec-8-enyl] ester Formula: C36H48N2O2 MolecularWeight: 540.77852

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCOC(=O)C1=CC2=C(C=C1)N=C3C2=C(C4=CN(C=CC4=C3C)C)C

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCOC(=O)C1=CC2=C(C=C1)N=C3C2=C(C4=CN(C=CC4=C3C)C)C

InChI

InChI=1S/C36H48N2O2/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-24-40-36(39)29-20-21-33-31(25-29)34-27(2)32-26-38(4)23-22-30(32)28(3)35(34)37-33/h12-13,20-23,25-26H,5-11,14-19,24H2,1-4H3/b13-12+