potassium 4-[(E)-C-methyl-N-(5-nitro-1,3-benzothiazol-2-yl)carbonimidoyl]phenolate

Systemtic Name: potassium 4-[(E)-C-methyl-N-(5-nitro-1,3-benzothiazol-2-yl)carbonimidoyl]phenolate Openeye Name: potassium 4-[(E)-C-methyl-N-(5-nitro-1,3-benzothiazol-2-yl)carbonimidoyl]phenolate CAS Name: potassium 4-[(1E)-1-[(5-nitro-1,3-benzothiazol-2-yl)imino]ethyl]phenolate IUPAC Name: potassium 4-[(E)-C-methyl-N-(5-nitro-1,3-benzothiazol-2-yl)carbonimidoyl]phenolate Traditional Name: potassium 4-[(E)-C-methyl-N-(5-nitro-1,3-benzothiazol-2-yl)carbonimidoyl]phenolate Formula: C15H10KN3O3S MolecularWeight: 351.4215

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NC1=NC2=C(S1)C=CC(=C2)[N+](=O)[O-])C3=CC=C(C=C3)[O-].[K+]

Isomeric SMILES

C/C(=N\C1=NC2=C(S1)C=CC(=C2)[N+](=O)[O-])/C3=CC=C(C=C3)[O-].[K+]

InChI

InChI=1S/C15H11N3O3S.K/c1-9(10-2-5-12(19)6-3-10)16-15-17-13-8-11(18(20)21)4-7-14(13)22-15;/h2-8,19H,1H3;/q;+1/p-1/b16-9+;