3-azanyl-2-[(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)methyl]-3-sulfanyl-prop-2-enoate

Systemtic Name: 3-azanyl-2-[(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)methyl]-3-sulfanyl-prop-2-enoate Openeye Name: 3-amino-2-[(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]-3-sulfanyl-prop-2-enoate CAS Name: 3-amino-3-mercapto-2-[(6-oxo-1-cyclohexa-2,4-dienylidene)methyl]-2-propenoate IUPAC Name: 3-amino-2-[(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]-3-sulfanylprop-2-enoate Traditional Name: 3-amino-2-[(6-ketocyclohexa-2,4-dien-1-ylidene)methyl]-3-mercapto-acrylate Formula: C10H8NO3S- MolecularWeight: 222.24042

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C(N)S)C(=O)[O-])C(=O)C=C1

Isomeric SMILES

C1=CC(=CC(=C(N)S)C(=O)[O-])C(=O)C=C1

InChI

InChI=1S/C10H9NO3S/c11-9(15)7(10(13)14)5-6-3-1-2-4-8(6)12/h1-5,15H,11H2,(H,13,14)/p-1