[2-(2,5-dibutoxyphenyl)-5-oxa-2-aza-7-azoniabicyclo[4.1.0]heptan-7-ylidene]azanide

Systemtic Name: [2-(2,5-dibutoxyphenyl)-5-oxa-2-aza-7-azoniabicyclo[4.1.0]heptan-7-ylidene]azanide Openeye Name: [2-(2,5-dibutoxyphenyl)-5-oxa-2-aza-7-azoniabicyclo[4.1.0]heptan-7-ylidene]azanide CAS Name: [2-(2,5-dibutoxyphenyl)-5-oxa-2-aza-7-azoniabicyclo[4.1.0]heptan-7-ylidene]azanide IUPAC Name: [2-(2,5-dibutoxyphenyl)-5-oxa-2-aza-7-azoniabicyclo[4.1.0]heptan-7-ylidene]azanide Traditional Name: [2-(2,5-dibutoxyphenyl)-5-oxa-2-aza-7-azoniabicyclo[4.1.0]heptan-7-ylidene]azanide Formula: C18H27N3O3 MolecularWeight: 333.42528

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC(=C(C=C1)OCCCC)N2CCOC3C2[N+]3=[N-]

Isomeric SMILES

CCCCOC1=CC(=C(C=C1)OCCCC)N2CCOC3C2[N+]3=[N-]

InChI

InChI=1S/C18H27N3O3/c1-3-5-10-22-14-7-8-16(23-11-6-4-2)15(13-14)20-9-12-24-18-17(20)21(18)19/h7-8,13,17-18H,3-6,9-12H2,1-2H3