(E)-2-(5-chloranyl-1,3-benzothiazol-2-yl)-3-(4-nitrophenyl)prop-2-enenitrile

Systemtic Name: (E)-2-(5-chloranyl-1,3-benzothiazol-2-yl)-3-(4-nitrophenyl)prop-2-enenitrile Openeye Name: (E)-2-(5-chloro-1,3-benzothiazol-2-yl)-3-(4-nitrophenyl)prop-2-enenitrile CAS Name: (E)-2-(5-chloro-1,3-benzothiazol-2-yl)-3-(4-nitrophenyl)-2-propenenitrile IUPAC Name: (E)-2-(5-chloro-1,3-benzothiazol-2-yl)-3-(4-nitrophenyl)prop-2-enenitrile Traditional Name: (E)-2-(5-chloro-1,3-benzothiazol-2-yl)-3-(4-nitrophenyl)acrylonitrile Formula: C16H8ClN3O2S MolecularWeight: 341.77162

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=C(C#N)C2=NC3=C(S2)C=CC(=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C16H8ClN3O2S/c17-12-3-6-15-14(8-12)19-16(23-15)11(9-18)7-10-1-4-13(5-2-10)20(21)22/h1-8H/b11-7+