6,7-dimethoxy-2-[(3S)-1-(1-propan-2-ylpiperidin-1-ium-4-yl)piperidin-3-yl]-1,2,3,4-tetrahydroisoquinolin-2-ium

Systemtic Name: 6,7-dimethoxy-2-[(3S)-1-(1-propan-2-ylpiperidin-1-ium-4-yl)piperidin-3-yl]-1,2,3,4-tetrahydroisoquinolin-2-ium Openeye Name: 2-[(3S)-1-(1-isopropylpiperidin-1-ium-4-yl)-3-piperidyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium CAS Name: 6,7-dimethoxy-2-[(3S)-1-(1-propan-2-yl-4-piperidin-1-iumyl)-3-piperidinyl]-1,2,3,4-tetrahydroisoquinolin-2-ium IUPAC Name: 6,7-dimethoxy-2-[(3S)-1-(1-propan-2-ylpiperidin-1-ium-4-yl)piperidin-3-yl]-1,2,3,4-tetrahydroisoquinolin-2-ium Traditional Name: 2-[(3S)-1-(1-isopropylpiperidin-1-ium-4-yl)-3-piperidyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium Formula: C24H41N3O2+2 MolecularWeight: 403.60124

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CCC(CC1)N2CCCC(C2)[NH+]3CCC4=CC(=C(C=C4C3)OC)OC

Isomeric SMILES

CC(C)[NH+]1CCC(CC1)N2CCC[C@@H](C2)[NH+]3CCC4=CC(=C(C=C4C3)OC)OC

InChI

InChI=1S/C24H39N3O2/c1-18(2)25-12-8-21(9-13-25)26-10-5-6-22(17-26)27-11-7-19-14-23(28-3)24(29-4)15-20(19)16-27/h14-15,18,21-22H,5-13,16-17H2,1-4H3/p+2/t22-/m0/s1