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

Systemtic Name: 1-(3,4,5-trimethoxyphenyl)-9H-pyrido[3,4-b]indole-3-carboxylic acid Openeye Name: 1-(3,4,5-trimethoxyphenyl)-9H-pyrido[3,4-b]indole-3-carboxylic acid CAS Name: 1-(3,4,5-trimethoxyphenyl)-9H-pyrido[3,4-b]indole-3-carboxylic acid IUPAC Name: 1-(3,4,5-trimethoxyphenyl)-9H-pyrido[3,4-b]indole-3-carboxylic acid Traditional Name: 1-(3,4,5-trimethoxyphenyl)-9H-$b-carboline-3-carboxylic acid Formula: C21H18N2O5 MolecularWeight: 378.37802

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=C3C(=CC(=N2)C(=O)O)C4=CC=CC=C4N3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=C3C(=CC(=N2)C(=O)O)C4=CC=CC=C4N3

InChI

InChI=1S/C21H18N2O5/c1-26-16-8-11(9-17(27-2)20(16)28-3)18-19-13(10-15(23-18)21(24)25)12-6-4-5-7-14(12)22-19/h4-10,22H,1-3H3,(H,24,25)