methyl 6-[3-[(4-methylphenyl)sulfonylamino]propanoylamino]-2-oxidanylidene-chromene-3-carboxylate

Systemtic Name: methyl 6-[3-[(4-methylphenyl)sulfonylamino]propanoylamino]-2-oxidanylidene-chromene-3-carboxylate Openeye Name: methyl 2-oxo-6-[3-(p-tolylsulfonylamino)propanoylamino]chromene-3-carboxylate CAS Name: 6-[[3-[(4-methylphenyl)sulfonylamino]-1-oxopropyl]amino]-2-oxo-1-benzopyran-3-carboxylic acid methyl ester IUPAC Name: methyl 6-[3-[(4-methylphenyl)sulfonylamino]propanoylamino]-2-oxochromene-3-carboxylate Traditional Name: 2-keto-6-[3-(tosylamino)propanoylamino]chromene-3-carboxylic acid methyl ester Formula: C21H20N2O7S MolecularWeight: 444.4577

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)NC2=CC3=C(C=C2)OC(=O)C(=C3)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)NC2=CC3=C(C=C2)OC(=O)C(=C3)C(=O)OC

InChI

InChI=1S/C21H20N2O7S/c1-13-3-6-16(7-4-13)31(27,28)22-10-9-19(24)23-15-5-8-18-14(11-15)12-17(20(25)29-2)21(26)30-18/h3-8,11-12,22H,9-10H2,1-2H3,(H,23,24)