6,7-dimethoxy-2-[(3S)-1-[(E)-2-methylbut-2-enyl]piperidin-1-ium-3-yl]-3,4-dihydro-1H-isoquinoline

Systemtic Name: 6,7-dimethoxy-2-[(3S)-1-[(E)-2-methylbut-2-enyl]piperidin-1-ium-3-yl]-3,4-dihydro-1H-isoquinoline Openeye Name: 6,7-dimethoxy-2-[(3S)-1-[(E)-2-methylbut-2-enyl]piperidin-1-ium-3-yl]-3,4-dihydro-1H-isoquinoline CAS Name: 6,7-dimethoxy-2-[(3S)-1-[(E)-2-methylbut-2-enyl]-3-piperidin-1-iumyl]-3,4-dihydro-1H-isoquinoline IUPAC Name: 6,7-dimethoxy-2-[(3S)-1-[(E)-2-methylbut-2-enyl]piperidin-1-ium-3-yl]-3,4-dihydro-1H-isoquinoline Traditional Name: 6,7-dimethoxy-2-[(3S)-1-[(E)-2-methylbut-2-enyl]piperidin-1-ium-3-yl]-3,4-dihydro-1H-isoquinoline Formula: C21H33N2O2+ MolecularWeight: 345.49892

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Descriptors Computed from Structure

Canonical SMILES:

CC=C(C)C[NH+]1CCCC(C1)N2CCC3=CC(=C(C=C3C2)OC)OC

Isomeric SMILES

C/C=C(\C)/C[NH+]1CCC[C@@H](C1)N2CCC3=CC(=C(C=C3C2)OC)OC

InChI

InChI=1S/C21H32N2O2/c1-5-16(2)13-22-9-6-7-19(15-22)23-10-8-17-11-20(24-3)21(25-4)12-18(17)14-23/h5,11-12,19H,6-10,13-15H2,1-4H3/p+1/b16-5+/t19-/m0/s1