[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl] 3-(3-methoxyphenyl)-2-phenyl-prop-2-enoate

Systemtic Name: [2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl] 3-(3-methoxyphenyl)-2-phenyl-prop-2-enoate Openeye Name: [2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl] 3-(3-methoxyphenyl)-2-phenyl-prop-2-enoate CAS Name: 3-(3-methoxyphenyl)-2-phenyl-2-propenoic acid [2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl] ester IUPAC Name: [2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl] 3-(3-methoxyphenyl)-2-phenylprop-2-enoate Traditional Name: 3-(3-methoxyphenyl)-2-phenyl-acrylic acid [2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-ethyl] ester Formula: C27H25NO4 MolecularWeight: 427.4917

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C=C(C2=CC=CC=C2)C(=O)OCC(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

COC1=CC=CC(=C1)C=C(C2=CC=CC=C2)C(=O)OCC(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C27H25NO4/c1-31-24-13-7-8-20(16-24)17-25(22-10-3-2-4-11-22)27(30)32-19-26(29)28-15-14-21-9-5-6-12-23(21)18-28/h2-13,16-17H,14-15,18-19H2,1H3