8,10-dimethyl-3-[2-(4-nitrophenyl)ethyl]-9-thia-3-aza-6-azoniaspiro[5.5]undecane

Systemtic Name: 8,10-dimethyl-3-[2-(4-nitrophenyl)ethyl]-9-thia-3-aza-6-azoniaspiro[5.5]undecane Openeye Name: 8,10-dimethyl-3-[2-(4-nitrophenyl)ethyl]-9-thia-3-aza-6-azoniaspiro[5.5]undecane CAS Name: 8,10-dimethyl-3-[2-(4-nitrophenyl)ethyl]-9-thia-3-aza-6-azoniaspiro[5.5]undecane IUPAC Name: 8,10-dimethyl-3-[2-(4-nitrophenyl)ethyl]-9-thia-3-aza-6-azoniaspiro[5.5]undecane Traditional Name: 8,10-dimethyl-3-[2-(4-nitrophenyl)ethyl]-9-thia-3-aza-6-azoniaspiro[5.5]undecane Formula: C18H28N3O2S+ MolecularWeight: 350.49882

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Descriptors Computed from Structure

Canonical SMILES:

CC1C[N+]2(CCN(CC2)CCC3=CC=C(C=C3)[N+](=O)[O-])CC(S1)C

Isomeric SMILES

CC1C[N+]2(CCN(CC2)CCC3=CC=C(C=C3)[N+](=O)[O-])CC(S1)C

InChI

InChI=1S/C18H28N3O2S/c1-15-13-21(14-16(2)24-15)11-9-19(10-12-21)8-7-17-3-5-18(6-4-17)20(22)23/h3-6,15-16H,7-14H2,1-2H3/q+1