methyl 3,9-dibutyl-1-methyl-4H-pyrido[3,4-b]indole-3-carboxylate

Systemtic Name: methyl 3,9-dibutyl-1-methyl-4H-pyrido[3,4-b]indole-3-carboxylate Openeye Name: methyl 3,9-dibutyl-1-methyl-4H-pyrido[3,4-b]indole-3-carboxylate CAS Name: 3,9-dibutyl-1-methyl-4H-pyrido[3,4-b]indole-3-carboxylic acid methyl ester IUPAC Name: methyl 3,9-dibutyl-1-methyl-4H-pyrido[3,4-b]indole-3-carboxylate Traditional Name: 3,9-dibutyl-1-methyl-4H-$b-carboline-3-carboxylic acid methyl ester Formula: C22H30N2O2 MolecularWeight: 354.4858

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(CC2=C(C(=N1)C)N(C3=CC=CC=C23)CCCC)C(=O)OC

Isomeric SMILES

CCCCC1(CC2=C(C(=N1)C)N(C3=CC=CC=C23)CCCC)C(=O)OC

InChI

InChI=1S/C22H30N2O2/c1-5-7-13-22(21(25)26-4)15-18-17-11-9-10-12-19(17)24(14-8-6-2)20(18)16(3)23-22/h9-12H,5-8,13-15H2,1-4H3