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

Systemtic Name: N-[[(1R)-6,7-dimethoxy-2-prop-2-enyl-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]methyl]-4-methyl-benzamide Openeye Name: N-[[(1R)-2-allyl-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]methyl]-4-methyl-benzamide CAS Name: N-[[(1R)-6,7-dimethoxy-2-prop-2-enyl-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]methyl]-4-methylbenzamide IUPAC Name: N-[[(1R)-6,7-dimethoxy-2-prop-2-enyl-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]methyl]-4-methylbenzamide Traditional Name: N-[[(1R)-2-allyl-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]methyl]-4-methyl-benzamide Formula: C23H29N2O3+ MolecularWeight: 381.48796

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NCC2C3=CC(=C(C=C3CC[NH+]2CC=C)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC[C@H]2C3=CC(=C(C=C3CC[NH+]2CC=C)OC)OC

InChI

InChI=1S/C23H28N2O3/c1-5-11-25-12-10-18-13-21(27-3)22(28-4)14-19(18)20(25)15-24-23(26)17-8-6-16(2)7-9-17/h5-9,13-14,20H,1,10-12,15H2,2-4H3,(H,24,26)/p+1/t20-/m0/s1