[4-methoxy-3-(1-propan-2-ylpiperidin-1-ium-4-yl)oxy-phenyl]-[(2R,6R)-6-methyl-2-prop-2-enyl-3,6-dihydro-2H-pyridin-1-yl]methanone

Systemtic Name: [4-methoxy-3-(1-propan-2-ylpiperidin-1-ium-4-yl)oxy-phenyl]-[(2R,6R)-6-methyl-2-prop-2-enyl-3,6-dihydro-2H-pyridin-1-yl]methanone Openeye Name: [(2R,6R)-2-allyl-6-methyl-3,6-dihydro-2H-pyridin-1-yl]-[3-(1-isopropylpiperidin-1-ium-4-yl)oxy-4-methoxy-phenyl]methanone CAS Name: [4-methoxy-3-[(1-propan-2-yl-4-piperidin-1-iumyl)oxy]phenyl]-[(2R,6R)-6-methyl-2-prop-2-enyl-3,6-dihydro-2H-pyridin-1-yl]methanone IUPAC Name: [4-methoxy-3-(1-propan-2-ylpiperidin-1-ium-4-yl)oxyphenyl]-[(2R,6R)-6-methyl-2-prop-2-enyl-3,6-dihydro-2H-pyridin-1-yl]methanone Traditional Name: [(2R,6R)-2-allyl-6-methyl-3,6-dihydro-2H-pyridin-1-yl]-[3-(1-isopropylpiperidin-1-ium-4-yl)oxy-4-methoxy-phenyl]methanone Formula: C25H37N2O3+ MolecularWeight: 413.57288

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Descriptors Computed from Structure

Canonical SMILES:

CC1C=CCC(N1C(=O)C2=CC(=C(C=C2)OC)OC3CC[NH+](CC3)C(C)C)CC=C

Isomeric SMILES

C[C@@H]1C=CC[C@H](N1C(=O)C2=CC(=C(C=C2)OC)OC3CC[NH+](CC3)C(C)C)CC=C

InChI

InChI=1S/C25H36N2O3/c1-6-8-21-10-7-9-19(4)27(21)25(28)20-11-12-23(29-5)24(17-20)30-22-13-15-26(16-14-22)18(2)3/h6-7,9,11-12,17-19,21-22H,1,8,10,13-16H2,2-5H3/p+1/t19-,21-/m1/s1