(phenylmethyl) 3-[4-[acridin-9-ylcarbonyl(2,3-dihydro-1,4-benzodioxin-6-yl)sulfamoyl]phenyl]propanoate

Systemtic Name: (phenylmethyl) 3-[4-[acridin-9-ylcarbonyl(2,3-dihydro-1,4-benzodioxin-6-yl)sulfamoyl]phenyl]propanoate Openeye Name: benzyl 3-[4-[acridine-9-carbonyl(2,3-dihydro-1,4-benzodioxin-6-yl)sulfamoyl]phenyl]propanoate CAS Name: 3-[4-[[9-acridinyl(oxo)methyl]-(2,3-dihydro-1,4-benzodioxin-6-yl)sulfamoyl]phenyl]propanoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-[4-[acridine-9-carbonyl(2,3-dihydro-1,4-benzodioxin-6-yl)sulfamoyl]phenyl]propanoate Traditional Name: 3-[4-[acridine-9-carbonyl(2,3-dihydro-1,4-benzodioxin-6-yl)sulfamoyl]phenyl]propionic acid benzyl ester Formula: C38H30N2O7S MolecularWeight: 658.719

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)N(C(=O)C3=C4C=CC=CC4=NC5=CC=CC=C53)S(=O)(=O)C6=CC=C(C=C6)CCC(=O)OCC7=CC=CC=C7

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)N(C(=O)C3=C4C=CC=CC4=NC5=CC=CC=C53)S(=O)(=O)C6=CC=C(C=C6)CCC(=O)OCC7=CC=CC=C7

InChI

InChI=1S/C38H30N2O7S/c41-36(47-25-27-8-2-1-3-9-27)21-16-26-14-18-29(19-15-26)48(43,44)40(28-17-20-34-35(24-28)46-23-22-45-34)38(42)37-30-10-4-6-12-32(30)39-33-13-7-5-11-31(33)37/h1-15,17-20,24H,16,21-23,25H2