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

Systemtic Name: (2-oxidanylidenechromen-7-yl) 2-[(4-methylphenyl)sulfonylamino]pentanoate Openeye Name: (2-oxochromen-7-yl) 2-(p-tolylsulfonylamino)pentanoate CAS Name: 2-[(4-methylphenyl)sulfonylamino]pentanoic acid (2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (2-oxochromen-7-yl) 2-[(4-methylphenyl)sulfonylamino]pentanoate Traditional Name: 2-(tosylamino)valeric acid (2-ketochromen-7-yl) ester Formula: C21H21NO6S MolecularWeight: 415.45954

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)OC1=CC2=C(C=C1)C=CC(=O)O2)NS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCCC(C(=O)OC1=CC2=C(C=C1)C=CC(=O)O2)NS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C21H21NO6S/c1-3-4-18(22-29(25,26)17-10-5-14(2)6-11-17)21(24)27-16-9-7-15-8-12-20(23)28-19(15)13-16/h5-13,18,22H,3-4H2,1-2H3