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2-[(E)-2-(6-nitro-1,3-benzothiazol-2-yl)ethenyl]benzoic acid

2-[(E)-2-(6-nitro-1,3-benzothiazol-2-yl)ethenyl]benzoic acid

Systemtic Name:2-[(E)-2-(6-nitro-1,3-benzothiazol-2-yl)ethenyl]benzoic acid
Openeye Name:2-[(E)-2-(6-nitro-1,3-benzothiazol-2-yl)vinyl]benzoic acid
CAS Name:2-[(E)-2-(6-nitro-1,3-benzothiazol-2-yl)ethenyl]benzoic acid
IUPAC Name:2-[(E)-2-(6-nitro-1,3-benzothiazol-2-yl)ethenyl]benzoic acid
Traditional Name:2-[(E)-2-(6-nitro-1,3-benzothiazol-2-yl)vinyl]benzoic acid
Formula: C16H10N2O4S
MolecularWeight: 326.3266
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C=CC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-])C(=O)O


Isomeric SMILES

C1=CC=C(C(=C1)/C=C/C2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-])C(=O)O


InChI

InChI=1S/C16H10N2O4S/c19-16(20)12-4-2-1-3-10(12)5-8-15-17-13-7-6-11(18(21)22)9-14(13)23-15/h1-9H,(H,19,20)/b8-5+


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