4-(5-methoxyindol-1-yl)butyl 1-methylpyridin-1-ium-3-carboxylate

Systemtic Name: 4-(5-methoxyindol-1-yl)butyl 1-methylpyridin-1-ium-3-carboxylate Openeye Name: 4-(5-methoxyindol-1-yl)butyl 1-methylpyridin-1-ium-3-carboxylate CAS Name: 1-methyl-3-pyridin-1-iumcarboxylic acid 4-(5-methoxy-1-indolyl)butyl ester IUPAC Name: 4-(5-methoxyindol-1-yl)butyl 1-methylpyridin-1-ium-3-carboxylate Traditional Name: 1-methylpyridin-1-ium-3-carboxylic acid 4-(5-methoxyindol-1-yl)butyl ester Formula: C20H23N2O3+ MolecularWeight: 339.40822

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=CC(=C1)C(=O)OCCCCN2C=CC3=C2C=CC(=C3)OC

Isomeric SMILES

C[N+]1=CC=CC(=C1)C(=O)OCCCCN2C=CC3=C2C=CC(=C3)OC

InChI

InChI=1S/C20H23N2O3/c1-21-10-5-6-17(15-21)20(23)25-13-4-3-11-22-12-9-16-14-18(24-2)7-8-19(16)22/h5-10,12,14-15H,3-4,11,13H2,1-2H3/q+1