4-[(1S)-6-ethoxy-7-methoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]-N,N-dimethyl-aniline

Systemtic Name: 4-[(1S)-6-ethoxy-7-methoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]-N,N-dimethyl-aniline Openeye Name: 4-[(1S)-6-ethoxy-7-methoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]-N,N-dimethyl-aniline CAS Name: 4-[(1S)-6-ethoxy-7-methoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]-N,N-dimethylaniline IUPAC Name: 4-[(1S)-6-ethoxy-7-methoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]-N,N-dimethylaniline Traditional Name: [4-[(1S)-6-ethoxy-7-methoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]phenyl]-dimethyl-amine Formula: C20H27N2O2+ MolecularWeight: 327.44058

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C([NH2+]CCC2=C1)C3=CC=C(C=C3)N(C)C)OC

Isomeric SMILES

CCOC1=C(C=C2[C@@H]([NH2+]CCC2=C1)C3=CC=C(C=C3)N(C)C)OC

InChI

InChI=1S/C20H26N2O2/c1-5-24-19-12-15-10-11-21-20(17(15)13-18(19)23-4)14-6-8-16(9-7-14)22(2)3/h6-9,12-13,20-21H,5,10-11H2,1-4H3/p+1/t20-/m0/s1