3-(methoxymethyl)-N-[3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propyl]benzamide

Systemtic Name: 3-(methoxymethyl)-N-[3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propyl]benzamide Openeye Name: 3-(methoxymethyl)-N-[3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propyl]benzamide CAS Name: 3-(methoxymethyl)-N-[3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propyl]benzamide IUPAC Name: 3-(methoxymethyl)-N-[3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propyl]benzamide Traditional Name: 3-(methoxymethyl)-N-[3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propyl]benzamide Formula: C21H27N2O2+ MolecularWeight: 339.45128

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=CC=CC(=C1)C(=O)NCCC[NH+]2CCC3=CC=CC=C3C2

Isomeric SMILES

COCC1=CC=CC(=C1)C(=O)NCCC[NH+]2CCC3=CC=CC=C3C2

InChI

InChI=1S/C21H26N2O2/c1-25-16-17-6-4-9-19(14-17)21(24)22-11-5-12-23-13-10-18-7-2-3-8-20(18)15-23/h2-4,6-9,14H,5,10-13,15-16H2,1H3,(H,22,24)/p+1