N-[[(1R)-6,7-dimethoxy-2-prop-2-enyl-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]methyl]-3-methyl-butanamide

Systemtic Name: N-[[(1R)-6,7-dimethoxy-2-prop-2-enyl-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]methyl]-3-methyl-butanamide Openeye Name: N-[[(1R)-2-allyl-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]methyl]-3-methyl-butanamide CAS Name: N-[[(1R)-6,7-dimethoxy-2-prop-2-enyl-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]methyl]-3-methylbutanamide IUPAC Name: N-[[(1R)-6,7-dimethoxy-2-prop-2-enyl-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]methyl]-3-methylbutanamide Traditional Name: N-[[(1R)-2-allyl-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]methyl]-3-methyl-butyramide Formula: C20H31N2O3+ MolecularWeight: 347.47174

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NCC1C2=CC(=C(C=C2CC[NH+]1CC=C)OC)OC

Isomeric SMILES

CC(C)CC(=O)NC[C@H]1C2=CC(=C(C=C2CC[NH+]1CC=C)OC)OC

InChI

InChI=1S/C20H30N2O3/c1-6-8-22-9-7-15-11-18(24-4)19(25-5)12-16(15)17(22)13-21-20(23)10-14(2)3/h6,11-12,14,17H,1,7-10,13H2,2-5H3,(H,21,23)/p+1/t17-/m0/s1