3-nitro-N-(4-oxidanylidene-3-phenyl-thiochromen-2-yl)benzamide

Systemtic Name: 3-nitro-N-(4-oxidanylidene-3-phenyl-thiochromen-2-yl)benzamide Openeye Name: 3-nitro-N-(4-oxo-3-phenyl-thiochromen-2-yl)benzamide CAS Name: 3-nitro-N-(4-oxo-3-phenyl-1-benzothiopyran-2-yl)benzamide IUPAC Name: 3-nitro-N-(4-oxo-3-phenylthiochromen-2-yl)benzamide Traditional Name: N-(4-keto-3-phenyl-thiochromen-2-yl)-3-nitro-benzamide Formula: C22H14N2O4S MolecularWeight: 402.42256

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(SC3=CC=CC=C3C2=O)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=C(SC3=CC=CC=C3C2=O)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H14N2O4S/c25-20-17-11-4-5-12-18(17)29-22(19(20)14-7-2-1-3-8-14)23-21(26)15-9-6-10-16(13-15)24(27)28/h1-13H,(H,23,26)