2-[[7-butoxy-2,4-bis(oxidanylidene)thiochromen-3-yl]carbonylamino]ethanoic acid

Systemtic Name: 2-[[7-butoxy-2,4-bis(oxidanylidene)thiochromen-3-yl]carbonylamino]ethanoic acid Openeye Name: 2-[(7-butoxy-2,4-dioxo-thiochromane-3-carbonyl)amino]acetic acid CAS Name: 2-[[(7-butoxy-2,4-dioxo-1-benzothiopyran-3-yl)-oxomethyl]amino]acetic acid IUPAC Name: 2-[(7-butoxy-2,4-dioxothiochromene-3-carbonyl)amino]acetic acid Traditional Name: 2-[(7-butoxy-2,4-diketo-thiochroman-3-carbonyl)amino]acetic acid Formula: C16H17NO6S MolecularWeight: 351.37428

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC2=C(C=C1)C(=O)C(C(=O)S2)C(=O)NCC(=O)O

Isomeric SMILES

CCCCOC1=CC2=C(C=C1)C(=O)C(C(=O)S2)C(=O)NCC(=O)O

InChI

InChI=1S/C16H17NO6S/c1-2-3-6-23-9-4-5-10-11(7-9)24-16(22)13(14(10)20)15(21)17-8-12(18)19/h4-5,7,13H,2-3,6,8H2,1H3,(H,17,21)(H,18,19)