(3,4,7-trimethyl-2-oxidanylidene-chromen-5-yl) 3-[(4-methylphenyl)sulfonylamino]propanoate

Systemtic Name: (3,4,7-trimethyl-2-oxidanylidene-chromen-5-yl) 3-[(4-methylphenyl)sulfonylamino]propanoate Openeye Name: (3,4,7-trimethyl-2-oxo-chromen-5-yl) 3-(p-tolylsulfonylamino)propanoate CAS Name: 3-[(4-methylphenyl)sulfonylamino]propanoic acid (3,4,7-trimethyl-2-oxo-1-benzopyran-5-yl) ester IUPAC Name: (3,4,7-trimethyl-2-oxochromen-5-yl) 3-[(4-methylphenyl)sulfonylamino]propanoate Traditional Name: 3-(tosylamino)propionic acid (2-keto-3,4,7-trimethyl-chromen-5-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)NCCC(=O)OC2=CC(=CC3=C2C(=C(C(=O)O3)C)C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)OC2=CC(=CC3=C2C(=C(C(=O)O3)C)C)C

InChI

InChI=1S/C22H23NO6S/c1-13-5-7-17(8-6-13)30(26,27)23-10-9-20(24)28-18-11-14(2)12-19-21(18)15(3)16(4)22(25)29-19/h5-8,11-12,23H,9-10H2,1-4H3