phenanthridin-6-ylmethyl (E)-3-[4-(cyanomethoxy)-3-methoxy-phenyl]prop-2-enoate

Systemtic Name: phenanthridin-6-ylmethyl (E)-3-[4-(cyanomethoxy)-3-methoxy-phenyl]prop-2-enoate Openeye Name: phenanthridin-6-ylmethyl (E)-3-[4-(cyanomethoxy)-3-methoxy-phenyl]prop-2-enoate CAS Name: (E)-3-[4-(cyanomethoxy)-3-methoxyphenyl]-2-propenoic acid 6-phenanthridinylmethyl ester IUPAC Name: phenanthridin-6-ylmethyl (E)-3-[4-(cyanomethoxy)-3-methoxyphenyl]prop-2-enoate Traditional Name: (E)-3-[4-(cyanomethoxy)-3-methoxy-phenyl]acrylic acid phenanthridin-6-ylmethyl ester Formula: C26H20N2O4 MolecularWeight: 424.448

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=CC(=O)OCC2=NC3=CC=CC=C3C4=CC=CC=C42)OCC#N

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/C(=O)OCC2=NC3=CC=CC=C3C4=CC=CC=C42)OCC#N

InChI

InChI=1S/C26H20N2O4/c1-30-25-16-18(10-12-24(25)31-15-14-27)11-13-26(29)32-17-23-21-8-3-2-6-19(21)20-7-4-5-9-22(20)28-23/h2-13,16H,15,17H2,1H3/b13-11+