(E)-3-(3,4-dimethoxyphenyl)-1-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)prop-2-en-1-one

Systemtic Name: (E)-3-(3,4-dimethoxyphenyl)-1-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)prop-2-en-1-one Openeye Name: (E)-3-(3,4-dimethoxyphenyl)-1-[6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinolin-2-yl]prop-2-en-1-one CAS Name: (E)-3-(3,4-dimethoxyphenyl)-1-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)-2-propen-1-one IUPAC Name: (E)-3-(3,4-dimethoxyphenyl)-1-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)prop-2-en-1-one Traditional Name: (E)-3-(3,4-dimethoxyphenyl)-1-[6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinolin-2-yl]prop-2-en-1-one Formula: C26H27NO5S MolecularWeight: 465.56128

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)N2CCC3=CC(=C(C=C3C2C4=CC=CS4)OC)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/C(=O)N2CCC3=CC(=C(C=C3C2C4=CC=CS4)OC)OC)OC

InChI

InChI=1S/C26H27NO5S/c1-29-20-9-7-17(14-21(20)30-2)8-10-25(28)27-12-11-18-15-22(31-3)23(32-4)16-19(18)26(27)24-6-5-13-33-24/h5-10,13-16,26H,11-12H2,1-4H3/b10-8+