9-butyl-1-(3,4,5-trimethoxyphenyl)pyrido[3,4-b]indole-3-carboxylic acid

Systemtic Name: 9-butyl-1-(3,4,5-trimethoxyphenyl)pyrido[3,4-b]indole-3-carboxylic acid Openeye Name: 9-butyl-1-(3,4,5-trimethoxyphenyl)pyrido[3,4-b]indole-3-carboxylic acid CAS Name: 9-butyl-1-(3,4,5-trimethoxyphenyl)-3-pyrido[3,4-b]indolecarboxylic acid IUPAC Name: 9-butyl-1-(3,4,5-trimethoxyphenyl)pyrido[3,4-b]indole-3-carboxylic acid Traditional Name: 9-butyl-1-(3,4,5-trimethoxyphenyl)-$b-carboline-3-carboxylic acid Formula: C25H26N2O5 MolecularWeight: 434.48434

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=CC=CC=C2C3=CC(=NC(=C31)C4=CC(=C(C(=C4)OC)OC)OC)C(=O)O

Isomeric SMILES

CCCCN1C2=CC=CC=C2C3=CC(=NC(=C31)C4=CC(=C(C(=C4)OC)OC)OC)C(=O)O

InChI

InChI=1S/C25H26N2O5/c1-5-6-11-27-19-10-8-7-9-16(19)17-14-18(25(28)29)26-22(23(17)27)15-12-20(30-2)24(32-4)21(13-15)31-3/h7-10,12-14H,5-6,11H2,1-4H3,(H,28,29)