2-[(Z)-2-chloranyl-3-phenyl-prop-2-enyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium

Systemtic Name: 2-[(Z)-2-chloranyl-3-phenyl-prop-2-enyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium Openeye Name: 2-[(Z)-2-chloro-3-phenyl-allyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium CAS Name: 2-[(Z)-2-chloro-3-phenylprop-2-enyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium IUPAC Name: 2-[(Z)-2-chloro-3-phenylprop-2-enyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium Traditional Name: 2-[(Z)-2-chloro-3-phenyl-allyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium Formula: C20H23ClNO2+ MolecularWeight: 344.85512

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C[NH+](CCC2=C1)CC(=CC3=CC=CC=C3)Cl)OC

Isomeric SMILES

COC1=C(C=C2C[NH+](CCC2=C1)C/C(=C/C3=CC=CC=C3)/Cl)OC

InChI

InChI=1S/C20H22ClNO2/c1-23-19-11-16-8-9-22(13-17(16)12-20(19)24-2)14-18(21)10-15-6-4-3-5-7-15/h3-7,10-12H,8-9,13-14H2,1-2H3/p+1/b18-10-