4-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethoxy]-3-methoxy-benzenecarbonitrile

Systemtic Name: 4-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethoxy]-3-methoxy-benzenecarbonitrile Openeye Name: 4-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethoxy]-3-methoxy-benzonitrile CAS Name: 4-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethoxy]-3-methoxybenzonitrile IUPAC Name: 4-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethoxy]-3-methoxybenzonitrile Traditional Name: 4-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-ethoxy]-3-methoxy-benzonitrile Formula: C21H22N2O5 MolecularWeight: 382.40978

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)C(=O)COC3=C(C=C(C=C3)C#N)OC)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)C(=O)COC3=C(C=C(C=C3)C#N)OC)OC

InChI

InChI=1S/C21H22N2O5/c1-25-18-8-14(11-22)4-5-17(18)28-13-21(24)23-7-6-15-9-19(26-2)20(27-3)10-16(15)12-23/h4-5,8-10H,6-7,12-13H2,1-3H3