N'-[(E)-[4-[(1-methylpyridin-1-ium-4-yl)methoxy]phenyl]methylideneamino]-1-pyrrolidin-1-ium-1-ylidene-methanediamine

Systemtic Name: N'-[(E)-[4-[(1-methylpyridin-1-ium-4-yl)methoxy]phenyl]methylideneamino]-1-pyrrolidin-1-ium-1-ylidene-methanediamine Openeye Name: N'-[(E)-[4-[(1-methylpyridin-1-ium-4-yl)methoxy]phenyl]methyleneamino]-1-pyrrolidin-1-ium-1-ylidene-methanediamine CAS Name: N'-[(E)-[4-[(1-methyl-4-pyridin-1-iumyl)methoxy]phenyl]methylideneamino]-1-(1-pyrrolidin-1-iumylidene)methanediamine IUPAC Name: N'-[(E)-[4-[(1-methylpyridin-1-ium-4-yl)methoxy]phenyl]methylideneamino]-1-pyrrolidin-1-ium-1-ylidenemethanediamine Traditional Name: [amino(pyrrolidin-1-ium-1-ylidene)methyl]-[(E)-[4-[(1-methylpyridin-1-ium-4-yl)methoxy]benzylidene]amino]amine Formula: C19H25N5O+2 MolecularWeight: 339.4347

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=C(C=C1)COC2=CC=C(C=C2)C=NNC(=[N+]3CCCC3)N

Isomeric SMILES

C[N+]1=CC=C(C=C1)COC2=CC=C(C=C2)/C=N/NC(=[N+]3CCCC3)N

InChI

InChI=1S/C19H24N5O/c1-23-12-8-17(9-13-23)15-25-18-6-4-16(5-7-18)14-21-22-19(20)24-10-2-3-11-24/h4-9,12-14H,2-3,10-11,15H2,1H3,(H2,20,22)/q+1/p+1/b21-14+