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

Systemtic Name: phenanthridin-6-ylmethyl (E)-3-[4-methoxy-3-(propan-2-ylsulfamoyl)phenyl]prop-2-enoate Openeye Name: phenanthridin-6-ylmethyl (E)-3-[3-(isopropylsulfamoyl)-4-methoxy-phenyl]prop-2-enoate CAS Name: (E)-3-[4-methoxy-3-(propan-2-ylsulfamoyl)phenyl]-2-propenoic acid 6-phenanthridinylmethyl ester IUPAC Name: phenanthridin-6-ylmethyl (E)-3-[4-methoxy-3-(propan-2-ylsulfamoyl)phenyl]prop-2-enoate Traditional Name: (E)-3-[3-(isopropylsulfamoyl)-4-methoxy-phenyl]acrylic acid phenanthridin-6-ylmethyl ester Formula: C27H26N2O5S MolecularWeight: 490.57074

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H26N2O5S/c1-18(2)29-35(31,32)26-16-19(12-14-25(26)33-3)13-15-27(30)34-17-24-22-10-5-4-8-20(22)21-9-6-7-11-23(21)28-24/h4-16,18,29H,17H2,1-3H3/b15-13+