[4-methyl-2-oxidanylidene-3-(phenylmethyl)chromen-7-yl] 6-[(4-methylphenyl)sulfonylamino]hexanoate

Systemtic Name: [4-methyl-2-oxidanylidene-3-(phenylmethyl)chromen-7-yl] 6-[(4-methylphenyl)sulfonylamino]hexanoate Openeye Name: (3-benzyl-4-methyl-2-oxo-chromen-7-yl) 6-(p-tolylsulfonylamino)hexanoate CAS Name: 6-[(4-methylphenyl)sulfonylamino]hexanoic acid [4-methyl-2-oxo-3-(phenylmethyl)-1-benzopyran-7-yl] ester IUPAC Name: (3-benzyl-4-methyl-2-oxochromen-7-yl) 6-[(4-methylphenyl)sulfonylamino]hexanoate Traditional Name: 6-(tosylamino)hexanoic acid (3-benzyl-2-keto-4-methyl-chromen-7-yl) ester Formula: C30H31NO6S MolecularWeight: 533.63524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCCCCCC(=O)OC2=CC3=C(C=C2)C(=C(C(=O)O3)CC4=CC=CC=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCCCCCC(=O)OC2=CC3=C(C=C2)C(=C(C(=O)O3)CC4=CC=CC=C4)C

InChI

InChI=1S/C30H31NO6S/c1-21-12-15-25(16-13-21)38(34,35)31-18-8-4-7-11-29(32)36-24-14-17-26-22(2)27(30(33)37-28(26)20-24)19-23-9-5-3-6-10-23/h3,5-6,9-10,12-17,20,31H,4,7-8,11,18-19H2,1-2H3