ethyl 4-[(6-ethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl-(phenylmethyl)sulfamoyl]benzoate

Systemtic Name: ethyl 4-[(6-ethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl-(phenylmethyl)sulfamoyl]benzoate Openeye Name: ethyl 4-[benzyl-[(6-ethyl-2-oxo-1H-quinolin-3-yl)methyl]sulfamoyl]benzoate CAS Name: 4-[(6-ethyl-2-oxo-1H-quinolin-3-yl)methyl-(phenylmethyl)sulfamoyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[benzyl-[(6-ethyl-2-oxo-1H-quinolin-3-yl)methyl]sulfamoyl]benzoate Traditional Name: 4-[benzyl-[(6-ethyl-2-keto-1H-quinolin-3-yl)methyl]sulfamoyl]benzoic acid ethyl ester Formula: C28H28N2O5S MolecularWeight: 504.59732

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CC3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)C(=O)OCC

Isomeric SMILES

CCC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CC3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)C(=O)OCC

InChI

InChI=1S/C28H28N2O5S/c1-3-20-10-15-26-23(16-20)17-24(27(31)29-26)19-30(18-21-8-6-5-7-9-21)36(33,34)25-13-11-22(12-14-25)28(32)35-4-2/h5-17H,3-4,18-19H2,1-2H3,(H,29,31)