2-methoxy-6-nitro-4-[(Z)-(4-oxidanylidene-2-piperidin-1-yl-1,3-thiazol-5-ylidene)methyl]phenolate

Systemtic Name: 2-methoxy-6-nitro-4-[(Z)-(4-oxidanylidene-2-piperidin-1-yl-1,3-thiazol-5-ylidene)methyl]phenolate Openeye Name: 2-methoxy-6-nitro-4-[(Z)-[4-oxo-2-(1-piperidyl)thiazol-5-ylidene]methyl]phenolate CAS Name: 2-methoxy-6-nitro-4-[(Z)-[4-oxo-2-(1-piperidinyl)-5-thiazolylidene]methyl]phenolate IUPAC Name: 2-methoxy-6-nitro-4-[(Z)-(4-oxo-2-piperidin-1-yl-1,3-thiazol-5-ylidene)methyl]phenolate Traditional Name: 4-[(Z)-(4-keto-2-piperidino-2-thiazolin-5-ylidene)methyl]-2-methoxy-6-nitro-phenolate Formula: C16H16N3O5S- MolecularWeight: 362.38034

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1[O-])[N+](=O)[O-])C=C2C(=O)N=C(S2)N3CCCCC3

Isomeric SMILES

COC1=CC(=CC(=C1[O-])[N+](=O)[O-])/C=C\2/C(=O)N=C(S2)N3CCCCC3

InChI

InChI=1S/C16H17N3O5S/c1-24-12-8-10(7-11(14(12)20)19(22)23)9-13-15(21)17-16(25-13)18-5-3-2-4-6-18/h7-9,20H,2-6H2,1H3/p-1/b13-9-