4-(1,3-benzothiazol-2-yl)-2-nitro-aniline

Systemtic Name: 4-(1,3-benzothiazol-2-yl)-2-nitro-aniline Openeye Name: 4-(1,3-benzothiazol-2-yl)-2-nitro-aniline CAS Name: 4-(1,3-benzothiazol-2-yl)-2-nitroaniline IUPAC Name: 4-(1,3-benzothiazol-2-yl)-2-nitroaniline Traditional Name: [4-(1,3-benzothiazol-2-yl)-2-nitro-phenyl]amine Formula: C13H9N3O2S MolecularWeight: 271.29446

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C3=CC(=C(C=C3)N)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C3=CC(=C(C=C3)N)[N+](=O)[O-]

InChI

InChI=1S/C13H9N3O2S/c14-9-6-5-8(7-11(9)16(17)18)13-15-10-3-1-2-4-12(10)19-13/h1-7H,14H2