[2-methyl-3-(4-nitrophenyl)-4-oxidanylidene-chromen-7-yl] 2-[(4-methylphenyl)sulfonylamino]propanoate

Systemtic Name: [2-methyl-3-(4-nitrophenyl)-4-oxidanylidene-chromen-7-yl] 2-[(4-methylphenyl)sulfonylamino]propanoate Openeye Name: [2-methyl-3-(4-nitrophenyl)-4-oxo-chromen-7-yl] 2-(p-tolylsulfonylamino)propanoate CAS Name: 2-[(4-methylphenyl)sulfonylamino]propanoic acid [2-methyl-3-(4-nitrophenyl)-4-oxo-1-benzopyran-7-yl] ester IUPAC Name: [2-methyl-3-(4-nitrophenyl)-4-oxochromen-7-yl] 2-[(4-methylphenyl)sulfonylamino]propanoate Traditional Name: 2-(tosylamino)propionic acid [4-keto-2-methyl-3-(4-nitrophenyl)chromen-7-yl] ester Formula: C26H22N2O8S MolecularWeight: 522.52648

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(C)C(=O)OC2=CC3=C(C=C2)C(=O)C(=C(O3)C)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(C)C(=O)OC2=CC3=C(C=C2)C(=O)C(=C(O3)C)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C26H22N2O8S/c1-15-4-11-21(12-5-15)37(33,34)27-16(2)26(30)36-20-10-13-22-23(14-20)35-17(3)24(25(22)29)18-6-8-19(9-7-18)28(31)32/h4-14,16,27H,1-3H3