(6-chloranyl-3,4-dimethyl-2-oxidanylidene-chromen-7-yl) 4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoate

Systemtic Name: (6-chloranyl-3,4-dimethyl-2-oxidanylidene-chromen-7-yl) 4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoate Openeye Name: (6-chloro-3,4-dimethyl-2-oxo-chromen-7-yl) 4-methyl-2-(p-tolylsulfonylamino)pentanoate CAS Name: 4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoic acid (6-chloro-3,4-dimethyl-2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (6-chloro-3,4-dimethyl-2-oxochromen-7-yl) 4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoate Traditional Name: 4-methyl-2-(tosylamino)valeric acid (6-chloro-2-keto-3,4-dimethyl-chromen-7-yl) ester Formula: C24H26ClNO6S MolecularWeight: 491.98434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CC(C)C)C(=O)OC2=C(C=C3C(=C(C(=O)OC3=C2)C)C)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(CC(C)C)C(=O)OC2=C(C=C3C(=C(C(=O)OC3=C2)C)C)Cl

InChI

InChI=1S/C24H26ClNO6S/c1-13(2)10-20(26-33(29,30)17-8-6-14(3)7-9-17)24(28)32-22-12-21-18(11-19(22)25)15(4)16(5)23(27)31-21/h6-9,11-13,20,26H,10H2,1-5H3