9-(2-ethylbutyl)-N-(2-methyl-4-nitro-phenyl)-7-thia-9-azaspiro[4.4]nonan-8-imine

Systemtic Name: 9-(2-ethylbutyl)-N-(2-methyl-4-nitro-phenyl)-7-thia-9-azaspiro[4.4]nonan-8-imine Openeye Name: 9-(2-ethylbutyl)-N-(2-methyl-4-nitro-phenyl)-7-thia-9-azaspiro[4.4]nonan-8-imine CAS Name: 9-(2-ethylbutyl)-N-(2-methyl-4-nitrophenyl)-7-thia-9-azaspiro[4.4]nonan-8-imine IUPAC Name: 9-(2-ethylbutyl)-N-(2-methyl-4-nitrophenyl)-7-thia-9-azaspiro[4.4]nonan-8-imine Traditional Name: [9-(2-ethylbutyl)-7-thia-9-azaspiro[4.4]nonan-8-ylidene]-(2-methyl-4-nitro-phenyl)amine Formula: C20H29N3O2S MolecularWeight: 375.52816

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)CN1C(=NC2=C(C=C(C=C2)[N+](=O)[O-])C)SCC13CCCC3

Isomeric SMILES

CCC(CC)CN1C(=NC2=C(C=C(C=C2)[N+](=O)[O-])C)SCC13CCCC3

InChI

InChI=1S/C20H29N3O2S/c1-4-16(5-2)13-22-19(26-14-20(22)10-6-7-11-20)21-18-9-8-17(23(24)25)12-15(18)3/h8-9,12,16H,4-7,10-11,13-14H2,1-3H3