(2S)-2-azanyl-3-(4-sulfanylidenecyclohexa-1,5-dien-1-yl)propanoic acid

Systemtic Name: (2S)-2-azanyl-3-(4-sulfanylidenecyclohexa-1,5-dien-1-yl)propanoic acid Openeye Name: (2S)-2-amino-3-(4-thioxocyclohexa-1,5-dien-1-yl)propanoic acid CAS Name: (2S)-2-amino-3-(4-sulfanylidene-1-cyclohexa-1,5-dienyl)propanoic acid IUPAC Name: (2S)-2-amino-3-(4-sulfanylidenecyclohexa-1,5-dien-1-yl)propanoic acid Traditional Name: (2S)-2-amino-3-(4-thioxocyclohexa-1,5-dien-1-yl)propionic acid Formula: C9H11NO2S MolecularWeight: 197.25414

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Descriptors Computed from Structure

Canonical SMILES:

C1C=C(C=CC1=S)CC(C(=O)O)N

Isomeric SMILES

C1C=C(C=CC1=S)C[C@@H](C(=O)O)N

InChI

InChI=1S/C9H11NO2S/c10-8(9(11)12)5-6-1-3-7(13)4-2-6/h1-3,8H,4-5,10H2,(H,11,12)/t8-/m0/s1