4-methyl-6-octan-4-yl-9H-pyrido[3,4-b]indole-3-carboxylic acid

Systemtic Name: 4-methyl-6-octan-4-yl-9H-pyrido[3,4-b]indole-3-carboxylic acid Openeye Name: 4-methyl-6-(1-propylpentyl)-9H-pyrido[3,4-b]indole-3-carboxylic acid CAS Name: 4-methyl-6-octan-4-yl-9H-pyrido[3,4-b]indole-3-carboxylic acid IUPAC Name: 4-methyl-6-octan-4-yl-9H-pyrido[3,4-b]indole-3-carboxylic acid Traditional Name: 4-methyl-6-(1-propylpentyl)-9H-$b-carboline-3-carboxylic acid Formula: C21H26N2O2 MolecularWeight: 338.44334

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCC)C1=CC2=C(C=C1)NC3=CN=C(C(=C23)C)C(=O)O

Isomeric SMILES

CCCCC(CCC)C1=CC2=C(C=C1)NC3=CN=C(C(=C23)C)C(=O)O

InChI

InChI=1S/C21H26N2O2/c1-4-6-8-14(7-5-2)15-9-10-17-16(11-15)19-13(3)20(21(24)25)22-12-18(19)23-17/h9-12,14,23H,4-8H2,1-3H3,(H,24,25)