(E)-3-(5-nitrofuran-2-yl)-2-(4-oxidanylidene-1,3-benzothiazin-2-yl)prop-2-enenitrile

Systemtic Name: (E)-3-(5-nitrofuran-2-yl)-2-(4-oxidanylidene-1,3-benzothiazin-2-yl)prop-2-enenitrile Openeye Name: (E)-3-(5-nitro-2-furyl)-2-(4-oxo-1,3-benzothiazin-2-yl)prop-2-enenitrile CAS Name: (E)-3-(5-nitro-2-furanyl)-2-(4-oxo-1,3-benzothiazin-2-yl)-2-propenenitrile IUPAC Name: (E)-3-(5-nitrofuran-2-yl)-2-(4-oxo-1,3-benzothiazin-2-yl)prop-2-enenitrile Traditional Name: (E)-2-(4-keto-1,3-benzothiazin-2-yl)-3-(5-nitro-2-furyl)acrylonitrile Formula: C15H7N3O4S MolecularWeight: 325.29878

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N=C(S2)C(=CC3=CC=C(O3)[N+](=O)[O-])C#N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N=C(S2)/C(=C/C3=CC=C(O3)[N+](=O)[O-])/C#N

InChI

InChI=1S/C15H7N3O4S/c16-8-9(7-10-5-6-13(22-10)18(20)21)15-17-14(19)11-3-1-2-4-12(11)23-15/h1-7H/b9-7+