(8-methyl-2-oxidanylidene-4-phenyl-chromen-7-yl) 6-[(4-methylphenyl)sulfonylamino]hexanoate

Systemtic Name: (8-methyl-2-oxidanylidene-4-phenyl-chromen-7-yl) 6-[(4-methylphenyl)sulfonylamino]hexanoate Openeye Name: (8-methyl-2-oxo-4-phenyl-chromen-7-yl) 6-(p-tolylsulfonylamino)hexanoate CAS Name: 6-[(4-methylphenyl)sulfonylamino]hexanoic acid (8-methyl-2-oxo-4-phenyl-1-benzopyran-7-yl) ester IUPAC Name: (8-methyl-2-oxo-4-phenylchromen-7-yl) 6-[(4-methylphenyl)sulfonylamino]hexanoate Traditional Name: 6-(tosylamino)hexanoic acid (2-keto-8-methyl-4-phenyl-chromen-7-yl) ester Formula: C29H29NO6S MolecularWeight: 519.60866

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCCCCCC(=O)OC2=C(C3=C(C=C2)C(=CC(=O)O3)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCCCCCC(=O)OC2=C(C3=C(C=C2)C(=CC(=O)O3)C4=CC=CC=C4)C

InChI

InChI=1S/C29H29NO6S/c1-20-12-14-23(15-13-20)37(33,34)30-18-8-4-7-11-27(31)35-26-17-16-24-25(22-9-5-3-6-10-22)19-28(32)36-29(24)21(26)2/h3,5-6,9-10,12-17,19,30H,4,7-8,11,18H2,1-2H3