1-butyl-9H-pyrido[3,4-b]indole-3-carboxylic acid

Systemtic Name: 1-butyl-9H-pyrido[3,4-b]indole-3-carboxylic acid Openeye Name: 1-butyl-9H-pyrido[3,4-b]indole-3-carboxylic acid CAS Name: 1-butyl-9H-pyrido[3,4-b]indole-3-carboxylic acid IUPAC Name: 1-butyl-9H-pyrido[3,4-b]indole-3-carboxylic acid Traditional Name: 1-butyl-9H-$b-carboline-3-carboxylic acid Formula: C16H16N2O2 MolecularWeight: 268.31044

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C2C(=CC(=N1)C(=O)O)C3=CC=CC=C3N2

Isomeric SMILES

CCCCC1=C2C(=CC(=N1)C(=O)O)C3=CC=CC=C3N2

InChI

InChI=1S/C16H16N2O2/c1-2-3-7-13-15-11(9-14(17-13)16(19)20)10-6-4-5-8-12(10)18-15/h4-6,8-9,18H,2-3,7H2,1H3,(H,19,20)