3,4-dihydro-1H-isoquinolin-2-yl-[1-[(2,3-dimethoxyphenyl)methyl]piperidin-1-ium-4-yl]methanone

Systemtic Name: 3,4-dihydro-1H-isoquinolin-2-yl-[1-[(2,3-dimethoxyphenyl)methyl]piperidin-1-ium-4-yl]methanone Openeye Name: 3,4-dihydro-1H-isoquinolin-2-yl-[1-[(2,3-dimethoxyphenyl)methyl]piperidin-1-ium-4-yl]methanone CAS Name: 3,4-dihydro-1H-isoquinolin-2-yl-[1-[(2,3-dimethoxyphenyl)methyl]-4-piperidin-1-iumyl]methanone IUPAC Name: 3,4-dihydro-1H-isoquinolin-2-yl-[1-[(2,3-dimethoxyphenyl)methyl]piperidin-1-ium-4-yl]methanone Traditional Name: 3,4-dihydro-1H-isoquinolin-2-yl-(1-o-veratrylpiperidin-1-ium-4-yl)methanone Formula: C24H31N2O3+ MolecularWeight: 395.51454

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)C[NH+]2CCC(CC2)C(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

COC1=CC=CC(=C1OC)C[NH+]2CCC(CC2)C(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C24H30N2O3/c1-28-22-9-5-8-21(23(22)29-2)16-25-13-10-19(11-14-25)24(27)26-15-12-18-6-3-4-7-20(18)17-26/h3-9,19H,10-17H2,1-2H3/p+1