2-[(1R)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]-4-methyl-aniline

Systemtic Name: 2-[(1R)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]-4-methyl-aniline Openeye Name: 2-[(1R)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]-4-methyl-aniline CAS Name: 2-[(1R)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]-4-methylaniline IUPAC Name: 2-[(1R)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]-4-methylaniline Traditional Name: [2-[(1R)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]-4-methyl-phenyl]amine Formula: C18H23N2O2+ MolecularWeight: 299.38742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N)C2C3=CC(=C(C=C3CC[NH2+]2)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1)N)[C@H]2C3=CC(=C(C=C3CC[NH2+]2)OC)OC

InChI

InChI=1S/C18H22N2O2/c1-11-4-5-15(19)14(8-11)18-13-10-17(22-3)16(21-2)9-12(13)6-7-20-18/h4-5,8-10,18,20H,6-7,19H2,1-3H3/p+1/t18-/m1/s1