2-[[(E)-(2,2-dimethyl-4-oxidanylidene-thiochromen-3-ylidene)methyl]amino]ethanoic acid

Systemtic Name: 2-[[(E)-(2,2-dimethyl-4-oxidanylidene-thiochromen-3-ylidene)methyl]amino]ethanoic acid Openeye Name: 2-[[(E)-(2,2-dimethyl-4-oxo-thiochroman-3-ylidene)methyl]amino]acetic acid CAS Name: 2-[[(E)-(2,2-dimethyl-4-oxo-1-benzothiopyran-3-ylidene)methyl]amino]acetic acid IUPAC Name: 2-[[(E)-(2,2-dimethyl-4-oxothiochromen-3-ylidene)methyl]amino]acetic acid Traditional Name: 2-[[(E)-(4-keto-2,2-dimethyl-thiochroman-3-ylidene)methyl]amino]acetic acid Formula: C14H15NO3S MolecularWeight: 277.3388

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=CNCC(=O)O)C(=O)C2=CC=CC=C2S1)C

Isomeric SMILES

CC1(/C(=C/NCC(=O)O)/C(=O)C2=CC=CC=C2S1)C

InChI

InChI=1S/C14H15NO3S/c1-14(2)10(7-15-8-12(16)17)13(18)9-5-3-4-6-11(9)19-14/h3-7,15H,8H2,1-2H3,(H,16,17)/b10-7+