N,N-dimethyl-6-nitro-spiro[chromene-2,4'-oxane]-4-carbothioamide

Systemtic Name: N,N-dimethyl-6-nitro-spiro[chromene-2,4'-oxane]-4-carbothioamide Openeye Name: N,N-dimethyl-6-nitro-spiro[chromene-2,4'-tetrahydropyran]-4-carbothioamide CAS Name: N,N-dimethyl-6-nitro-4-spiro[1-benzopyran-2,4'-oxane]carbothioamide IUPAC Name: N,N-dimethyl-6-nitrospiro[chromene-2,4'-oxane]-4-carbothioamide Traditional Name: N,N-dimethyl-6-nitro-spiro[chromene-2,4'-tetrahydropyran]-4-carbothioamide Formula: C16H18N2O4S MolecularWeight: 334.39012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=S)C1=CC2(CCOCC2)OC3=C1C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CN(C)C(=S)C1=CC2(CCOCC2)OC3=C1C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H18N2O4S/c1-17(2)15(23)13-10-16(5-7-21-8-6-16)22-14-4-3-11(18(19)20)9-12(13)14/h3-4,9-10H,5-8H2,1-2H3