[1-[(3,4-diethoxyphenyl)methyl]-6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-thiophen-2-yl-methanone

Systemtic Name: [1-[(3,4-diethoxyphenyl)methyl]-6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-thiophen-2-yl-methanone Openeye Name: [1-[(3,4-diethoxyphenyl)methyl]-6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-(2-thienyl)methanone CAS Name: [1-[(3,4-diethoxyphenyl)methyl]-6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-thiophen-2-ylmethanone IUPAC Name: [1-[(3,4-diethoxyphenyl)methyl]-6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-thiophen-2-ylmethanone Traditional Name: [1-(3,4-diethoxybenzyl)-6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-(2-thienyl)methanone Formula: C29H35NO5S MolecularWeight: 509.6569

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CC2C3=CC(=C(C=C3CCN2C(=O)C4=CC=CS4)OCC)OCC)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CC2C3=CC(=C(C=C3CCN2C(=O)C4=CC=CS4)OCC)OCC)OCC

InChI

InChI=1S/C29H35NO5S/c1-5-32-24-12-11-20(17-25(24)33-6-2)16-23-22-19-27(35-8-4)26(34-7-3)18-21(22)13-14-30(23)29(31)28-10-9-15-36-28/h9-12,15,17-19,23H,5-8,13-14,16H2,1-4H3