(3,4-dimethoxy-5-prop-2-enyl-phenyl)-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)methanone

Systemtic Name: (3,4-dimethoxy-5-prop-2-enyl-phenyl)-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)methanone Openeye Name: (3-allyl-4,5-dimethoxy-phenyl)-[6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinolin-2-yl]methanone CAS Name: (3,4-dimethoxy-5-prop-2-enylphenyl)-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)methanone IUPAC Name: (3,4-dimethoxy-5-prop-2-enylphenyl)-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)methanone Traditional Name: (3-allyl-4,5-dimethoxy-phenyl)-[6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinolin-2-yl]methanone Formula: C27H29NO5S MolecularWeight: 479.58786

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)CC=C)C(=O)N2CCC3=CC(=C(C=C3C2C4=CC=CS4)OC)OC

Isomeric SMILES

COC1=CC(=CC(=C1OC)CC=C)C(=O)N2CCC3=CC(=C(C=C3C2C4=CC=CS4)OC)OC

InChI

InChI=1S/C27H29NO5S/c1-6-8-18-13-19(15-23(32-4)26(18)33-5)27(29)28-11-10-17-14-21(30-2)22(31-3)16-20(17)25(28)24-9-7-12-34-24/h6-7,9,12-16,25H,1,8,10-11H2,2-5H3