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

Systemtic Name: (4-butyl-6-chloranyl-2-oxidanylidene-chromen-7-yl) 4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoate Openeye Name: (4-butyl-6-chloro-2-oxo-chromen-7-yl) 4-methyl-2-(p-tolylsulfonylamino)pentanoate CAS Name: 4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoic acid (4-butyl-6-chloro-2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (4-butyl-6-chloro-2-oxochromen-7-yl) 4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoate Traditional Name: 4-methyl-2-(tosylamino)valeric acid (4-butyl-6-chloro-2-keto-chromen-7-yl) ester Formula: C26H30ClNO6S MolecularWeight: 520.0375

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=O)OC2=CC(=C(C=C12)Cl)OC(=O)C(CC(C)C)NS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCCCC1=CC(=O)OC2=CC(=C(C=C12)Cl)OC(=O)C(CC(C)C)NS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C26H30ClNO6S/c1-5-6-7-18-13-25(29)33-23-15-24(21(27)14-20(18)23)34-26(30)22(12-16(2)3)28-35(31,32)19-10-8-17(4)9-11-19/h8-11,13-16,22,28H,5-7,12H2,1-4H3