4-nitro-2-[[4-(1,3-thiazol-2-yl)piperazin-1-yl]methyl]phenolate

Systemtic Name: 4-nitro-2-[[4-(1,3-thiazol-2-yl)piperazin-1-yl]methyl]phenolate Openeye Name: 4-nitro-2-[(4-thiazol-2-ylpiperazin-1-yl)methyl]phenolate CAS Name: 4-nitro-2-[[4-(2-thiazolyl)-1-piperazinyl]methyl]phenolate IUPAC Name: 4-nitro-2-[[4-(1,3-thiazol-2-yl)piperazin-1-yl]methyl]phenolate Traditional Name: 4-nitro-2-[(4-thiazol-2-ylpiperazino)methyl]phenolate Formula: C14H15N4O3S- MolecularWeight: 319.3589

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=C(C=CC(=C2)[N+](=O)[O-])[O-])C3=NC=CS3

Isomeric SMILES

C1CN(CCN1CC2=C(C=CC(=C2)[N+](=O)[O-])[O-])C3=NC=CS3

InChI

InChI=1S/C14H16N4O3S/c19-13-2-1-12(18(20)21)9-11(13)10-16-4-6-17(7-5-16)14-15-3-8-22-14/h1-3,8-9,19H,4-7,10H2/p-1