(1R)-1-[(Z)-1-chloranyl-2-phenyl-ethenyl]-6,7-diethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium

Systemtic Name: (1R)-1-[(Z)-1-chloranyl-2-phenyl-ethenyl]-6,7-diethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium Openeye Name: (1R)-1-[(Z)-1-chloro-2-phenyl-vinyl]-6,7-diethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium CAS Name: (1R)-1-[(Z)-1-chloro-2-phenylethenyl]-6,7-diethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium IUPAC Name: (1R)-1-[(Z)-1-chloro-2-phenylethenyl]-6,7-diethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium Traditional Name: (1R)-1-[(Z)-1-chloro-2-phenyl-vinyl]-6,7-diethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium Formula: C21H25ClNO2+ MolecularWeight: 358.8817

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C([NH2+]CCC2=C1)C(=CC3=CC=CC=C3)Cl)OCC

Isomeric SMILES

CCOC1=C(C=C2[C@@H]([NH2+]CCC2=C1)/C(=C/C3=CC=CC=C3)/Cl)OCC

InChI

InChI=1S/C21H24ClNO2/c1-3-24-19-13-16-10-11-23-21(17(16)14-20(19)25-4-2)18(22)12-15-8-6-5-7-9-15/h5-9,12-14,21,23H,3-4,10-11H2,1-2H3/p+1/b18-12-/t21-/m1/s1