5-nitro-4-phenylazanyl-7-(trifluoromethyl)-1,3-benzodithiol-2-one

Systemtic Name: 5-nitro-4-phenylazanyl-7-(trifluoromethyl)-1,3-benzodithiol-2-one Openeye Name: 4-anilino-5-nitro-7-(trifluoromethyl)-1,3-benzodithiol-2-one CAS Name: 4-anilino-5-nitro-7-(trifluoromethyl)-1,3-benzodithiol-2-one IUPAC Name: 4-anilino-5-nitro-7-(trifluoromethyl)-1,3-benzodithiol-2-one Traditional Name: 4-anilino-5-nitro-7-(trifluoromethyl)-1,3-benzodithiol-2-one Formula: C14H7F3N2O3S2 MolecularWeight: 372.34219

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=C(C=C(C3=C2SC(=O)S3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)NC2=C(C=C(C3=C2SC(=O)S3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C14H7F3N2O3S2/c15-14(16,17)8-6-9(19(21)22)10(12-11(8)23-13(20)24-12)18-7-4-2-1-3-5-7/h1-6,18H