(2-oxidanylidenechromen-7-yl) 6-[(4-methylphenyl)sulfonylamino]hexanoate

Systemtic Name: (2-oxidanylidenechromen-7-yl) 6-[(4-methylphenyl)sulfonylamino]hexanoate Openeye Name: (2-oxochromen-7-yl) 6-(p-tolylsulfonylamino)hexanoate CAS Name: 6-[(4-methylphenyl)sulfonylamino]hexanoic acid (2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (2-oxochromen-7-yl) 6-[(4-methylphenyl)sulfonylamino]hexanoate Traditional Name: 6-(tosylamino)hexanoic acid (2-ketochromen-7-yl) ester Formula: C22H23NO6S MolecularWeight: 429.48612

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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=CC(=O)O3

Isomeric SMILES

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

InChI

InChI=1S/C22H23NO6S/c1-16-6-11-19(12-7-16)30(26,27)23-14-4-2-3-5-21(24)28-18-10-8-17-9-13-22(25)29-20(17)15-18/h6-13,15,23H,2-5,14H2,1H3