N-methyl-6-nitro-spiro[chromene-2,1'-cyclohexane]-4-carbothioamide

Systemtic Name: N-methyl-6-nitro-spiro[chromene-2,1'-cyclohexane]-4-carbothioamide Openeye Name: N-methyl-6-nitro-spiro[chromene-2,1'-cyclohexane]-4-carbothioamide CAS Name: N-methyl-6-nitro-4-spiro[1-benzopyran-2,1'-cyclohexane]carbothioamide IUPAC Name: N-methyl-6-nitrospiro[chromene-2,1'-cyclohexane]-4-carbothioamide Traditional Name: N-methyl-6-nitro-spiro[chromene-2,1'-cyclohexane]-4-carbothioamide Formula: C16H18N2O3S MolecularWeight: 318.39072

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)C1=CC2(CCCCC2)OC3=C1C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CNC(=S)C1=CC2(CCCCC2)OC3=C1C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H18N2O3S/c1-17-15(22)13-10-16(7-3-2-4-8-16)21-14-6-5-11(18(19)20)9-12(13)14/h5-6,9-10H,2-4,7-8H2,1H3,(H,17,22)