2-[(3,5-dinitrophenyl)amino]-4-oxidanylidene-5,6,7,8-tetrahydrothiochromene-3-carbonitrile

Systemtic Name: 2-[(3,5-dinitrophenyl)amino]-4-oxidanylidene-5,6,7,8-tetrahydrothiochromene-3-carbonitrile Openeye Name: 2-(3,5-dinitroanilino)-4-oxo-5,6,7,8-tetrahydrothiochromene-3-carbonitrile CAS Name: 2-(3,5-dinitroanilino)-4-oxo-5,6,7,8-tetrahydro-1-benzothiopyran-3-carbonitrile IUPAC Name: 2-(3,5-dinitroanilino)-4-oxo-5,6,7,8-tetrahydrothiochromene-3-carbonitrile Traditional Name: 2-(3,5-dinitroanilino)-4-keto-5,6,7,8-tetrahydrothiochromene-3-carbonitrile Formula: C16H12N4O5S MolecularWeight: 372.35528

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=O)C(=C(S2)NC3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-])C#N

Isomeric SMILES

C1CCC2=C(C1)C(=O)C(=C(S2)NC3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-])C#N

InChI

InChI=1S/C16H12N4O5S/c17-8-13-15(21)12-3-1-2-4-14(12)26-16(13)18-9-5-10(19(22)23)7-11(6-9)20(24)25/h5-7,18H,1-4H2