N-[1-[4-[(1,3-dimethylimidazol-1-ium-2-yl)diazenyl]phenyl]pyrrolidin-3-yl]ethanamide

Systemtic Name: N-[1-[4-[(1,3-dimethylimidazol-1-ium-2-yl)diazenyl]phenyl]pyrrolidin-3-yl]ethanamide Openeye Name: N-[1-[4-(1,3-dimethylimidazol-1-ium-2-yl)azophenyl]pyrrolidin-3-yl]acetamide CAS Name: N-[1-[4-[(1,3-dimethyl-2-imidazol-1-iumyl)azo]phenyl]-3-pyrrolidinyl]acetamide IUPAC Name: N-[1-[4-[(1,3-dimethylimidazol-1-ium-2-yl)diazenyl]phenyl]pyrrolidin-3-yl]acetamide Traditional Name: N-[1-[4-(1,3-dimethylimidazol-1-ium-2-yl)azophenyl]pyrrolidin-3-yl]acetamide Formula: C17H23N6O+ MolecularWeight: 327.40412

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1CCN(C1)C2=CC=C(C=C2)N=NC3=[N+](C=CN3C)C

Isomeric SMILES

CC(=O)NC1CCN(C1)C2=CC=C(C=C2)N=NC3=[N+](C=CN3C)C

InChI

InChI=1S/C17H22N6O/c1-13(24)18-15-8-9-23(12-15)16-6-4-14(5-7-16)19-20-17-21(2)10-11-22(17)3/h4-7,10-11,15H,8-9,12H2,1-3H3/p+1