methyl (E)-3-[4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethoxy]-3-methoxy-phenyl]prop-2-enoate

Systemtic Name: methyl (E)-3-[4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethoxy]-3-methoxy-phenyl]prop-2-enoate Openeye Name: methyl (E)-3-[4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethoxy]-3-methoxy-phenyl]prop-2-enoate CAS Name: (E)-3-[4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethoxy]-3-methoxyphenyl]-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-[4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethoxy]-3-methoxyphenyl]prop-2-enoate Traditional Name: (E)-3-[4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-ethoxy]-3-methoxy-phenyl]acrylic acid methyl ester Formula: C22H23NO5 MolecularWeight: 381.42172

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=CC(=O)OC)OCC(=O)N2CCC3=CC=CC=C3C2

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/C(=O)OC)OCC(=O)N2CCC3=CC=CC=C3C2

InChI

InChI=1S/C22H23NO5/c1-26-20-13-16(8-10-22(25)27-2)7-9-19(20)28-15-21(24)23-12-11-17-5-3-4-6-18(17)14-23/h3-10,13H,11-12,14-15H2,1-2H3/b10-8+