[6,7-diethoxy-3-(hydroxymethyl)-4-[1-(2-methoxyethyl)pyridin-1-ium-4-yl]naphthalen-2-yl]methanol

Systemtic Name: [6,7-diethoxy-3-(hydroxymethyl)-4-[1-(2-methoxyethyl)pyridin-1-ium-4-yl]naphthalen-2-yl]methanol Openeye Name: [6,7-diethoxy-3-(hydroxymethyl)-4-[1-(2-methoxyethyl)pyridin-1-ium-4-yl]-2-naphthyl]methanol CAS Name: [6,7-diethoxy-3-(hydroxymethyl)-4-[1-(2-methoxyethyl)-4-pyridin-1-iumyl]-2-naphthalenyl]methanol IUPAC Name: [6,7-diethoxy-3-(hydroxymethyl)-4-[1-(2-methoxyethyl)pyridin-1-ium-4-yl]naphthalen-2-yl]methanol Traditional Name: [6,7-diethoxy-4-[1-(2-methoxyethyl)pyridin-1-ium-4-yl]-3-methylol-2-naphthyl]methanol Formula: C24H30NO5+ MolecularWeight: 412.4987

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=CC(=C(C(=C2C=C1OCC)C3=CC=[N+](C=C3)CCOC)CO)CO

Isomeric SMILES

CCOC1=CC2=CC(=C(C(=C2C=C1OCC)C3=CC=[N+](C=C3)CCOC)CO)CO

InChI

InChI=1S/C24H30NO5/c1-4-29-22-13-18-12-19(15-26)21(16-27)24(20(18)14-23(22)30-5-2)17-6-8-25(9-7-17)10-11-28-3/h6-9,12-14,26-27H,4-5,10-11,15-16H2,1-3H3/q+1