1-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)-4-(4-ethoxyphenyl)butane-1,4-dione

Systemtic Name: 1-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)-4-(4-ethoxyphenyl)butane-1,4-dione Openeye Name: 1-[6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinolin-2-yl]-4-(4-ethoxyphenyl)butane-1,4-dione CAS Name: 1-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)-4-(4-ethoxyphenyl)butane-1,4-dione IUPAC Name: 1-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)-4-(4-ethoxyphenyl)butane-1,4-dione Traditional Name: 1-[6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinolin-2-yl]-4-p-phenetyl-butane-1,4-dione Formula: C27H29NO5S MolecularWeight: 479.58786

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)CCC(=O)N2CCC3=CC(=C(C=C3C2C4=CC=CS4)OC)OC

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)CCC(=O)N2CCC3=CC(=C(C=C3C2C4=CC=CS4)OC)OC

InChI

InChI=1S/C27H29NO5S/c1-4-33-20-9-7-18(8-10-20)22(29)11-12-26(30)28-14-13-19-16-23(31-2)24(32-3)17-21(19)27(28)25-6-5-15-34-25/h5-10,15-17,27H,4,11-14H2,1-3H3