4-nitro-N-[1-(4-nitrophenyl)carbonyl-2,1-benzothiazol-3-ylidene]benzamide

Systemtic Name: 4-nitro-N-[1-(4-nitrophenyl)carbonyl-2,1-benzothiazol-3-ylidene]benzamide Openeye Name: 4-nitro-N-[1-(4-nitrobenzoyl)-2,1-benzothiazol-3-ylidene]benzamide CAS Name: 4-nitro-N-[1-[(4-nitrophenyl)-oxomethyl]-2,1-benzothiazol-3-ylidene]benzamide IUPAC Name: 4-nitro-N-[1-(4-nitrobenzoyl)-2,1-benzothiazol-3-ylidene]benzamide Traditional Name: 4-nitro-N-[1-(4-nitrobenzoyl)-2,1-benzothiazol-3-ylidene]benzamide Formula: C21H12N4O6S MolecularWeight: 448.40818

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])SN2C(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])SN2C(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H12N4O6S/c26-19(13-5-9-15(10-6-13)24(28)29)22-20-17-3-1-2-4-18(17)23(32-20)21(27)14-7-11-16(12-8-14)25(30)31/h1-12H