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

Systemtic Name: phenanthridin-6-ylmethyl (E)-3-[4-methoxy-3-(methylsulfamoyl)phenyl]prop-2-enoate Openeye Name: phenanthridin-6-ylmethyl (E)-3-[4-methoxy-3-(methylsulfamoyl)phenyl]prop-2-enoate CAS Name: (E)-3-[4-methoxy-3-(methylsulfamoyl)phenyl]-2-propenoic acid 6-phenanthridinylmethyl ester IUPAC Name: phenanthridin-6-ylmethyl (E)-3-[4-methoxy-3-(methylsulfamoyl)phenyl]prop-2-enoate Traditional Name: (E)-3-[4-methoxy-3-(methylsulfamoyl)phenyl]acrylic acid phenanthridin-6-ylmethyl ester Formula: C25H22N2O5S MolecularWeight: 462.51758

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Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)C1=C(C=CC(=C1)C=CC(=O)OCC2=NC3=CC=CC=C3C4=CC=CC=C42)OC

Isomeric SMILES

CNS(=O)(=O)C1=C(C=CC(=C1)/C=C/C(=O)OCC2=NC3=CC=CC=C3C4=CC=CC=C42)OC

InChI

InChI=1S/C25H22N2O5S/c1-26-33(29,30)24-15-17(11-13-23(24)31-2)12-14-25(28)32-16-22-20-9-4-3-7-18(20)19-8-5-6-10-21(19)27-22/h3-15,26H,16H2,1-2H3/b14-12+