2-methoxy-6-nitro-4-[(Z)-(3-oxidanylidene-1-benzothiophen-2-ylidene)methyl]phenolate

Systemtic Name: 2-methoxy-6-nitro-4-[(Z)-(3-oxidanylidene-1-benzothiophen-2-ylidene)methyl]phenolate Openeye Name: 2-methoxy-6-nitro-4-[(Z)-(3-oxobenzothiophen-2-ylidene)methyl]phenolate CAS Name: 2-methoxy-6-nitro-4-[(Z)-(3-oxo-1-benzothiophen-2-ylidene)methyl]phenolate IUPAC Name: 2-methoxy-6-nitro-4-[(Z)-(3-oxo-1-benzothiophen-2-ylidene)methyl]phenolate Traditional Name: 4-[(Z)-(3-ketobenzothiophen-2-ylidene)methyl]-2-methoxy-6-nitro-phenolate Formula: C16H10NO5S- MolecularWeight: 328.3193

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1[O-])[N+](=O)[O-])C=C2C(=O)C3=CC=CC=C3S2

Isomeric SMILES

COC1=CC(=CC(=C1[O-])[N+](=O)[O-])/C=C\2/C(=O)C3=CC=CC=C3S2

InChI

InChI=1S/C16H11NO5S/c1-22-12-7-9(6-11(16(12)19)17(20)21)8-14-15(18)10-4-2-3-5-13(10)23-14/h2-8,19H,1H3/p-1/b14-8-