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

Systemtic Name: 2-[[(E)-(2,2-dimethyl-4-oxidanylidene-thiochromen-3-ylidene)methyl]amino]propanoic acid Openeye Name: 2-[[(E)-(2,2-dimethyl-4-oxo-thiochroman-3-ylidene)methyl]amino]propanoic acid CAS Name: 2-[[(E)-(2,2-dimethyl-4-oxo-1-benzothiopyran-3-ylidene)methyl]amino]propanoic acid IUPAC Name: 2-[[(E)-(2,2-dimethyl-4-oxothiochromen-3-ylidene)methyl]amino]propanoic acid Traditional Name: 2-[[(E)-(4-keto-2,2-dimethyl-thiochroman-3-ylidene)methyl]amino]propionic acid Formula: C15H17NO3S MolecularWeight: 291.36538

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NC=C1C(=O)C2=CC=CC=C2SC1(C)C

Isomeric SMILES

CC(C(=O)O)N/C=C/1\C(=O)C2=CC=CC=C2SC1(C)C

InChI

InChI=1S/C15H17NO3S/c1-9(14(18)19)16-8-11-13(17)10-6-4-5-7-12(10)20-15(11,2)3/h4-9,16H,1-3H3,(H,18,19)/b11-8+