(2-oxidanylidenechromen-7-yl) 4-[[(4-methylphenyl)sulfonylamino]methyl]cyclohexane-1-carboxylate

Systemtic Name: (2-oxidanylidenechromen-7-yl) 4-[[(4-methylphenyl)sulfonylamino]methyl]cyclohexane-1-carboxylate Openeye Name: (2-oxochromen-7-yl) 4-[(p-tolylsulfonylamino)methyl]cyclohexanecarboxylate CAS Name: 4-[[(4-methylphenyl)sulfonylamino]methyl]-1-cyclohexanecarboxylic acid (2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (2-oxochromen-7-yl) 4-[[(4-methylphenyl)sulfonylamino]methyl]cyclohexane-1-carboxylate Traditional Name: 4-[(tosylamino)methyl]cyclohexanecarboxylic acid (2-ketochromen-7-yl) ester Formula: C24H25NO6S MolecularWeight: 455.5234

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCC2CCC(CC2)C(=O)OC3=CC4=C(C=C3)C=CC(=O)O4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCC2CCC(CC2)C(=O)OC3=CC4=C(C=C3)C=CC(=O)O4

InChI

InChI=1S/C24H25NO6S/c1-16-2-11-21(12-3-16)32(28,29)25-15-17-4-6-19(7-5-17)24(27)30-20-10-8-18-9-13-23(26)31-22(18)14-20/h2-3,8-14,17,19,25H,4-7,15H2,1H3