N'-(3,3-dimethyl-5-pyrrolidin-1-ium-1-yl-cyclohexa-1,5-dien-1-yl)-4-nitro-benzohydrazide

Systemtic Name: N'-(3,3-dimethyl-5-pyrrolidin-1-ium-1-yl-cyclohexa-1,5-dien-1-yl)-4-nitro-benzohydrazide Openeye Name: N'-(3,3-dimethyl-5-pyrrolidin-1-ium-1-yl-cyclohexa-1,5-dien-1-yl)-4-nitro-benzohydrazide CAS Name: N'-[3,3-dimethyl-5-(1-pyrrolidin-1-iumyl)-1-cyclohexa-1,5-dienyl]-4-nitrobenzohydrazide IUPAC Name: N'-(3,3-dimethyl-5-pyrrolidin-1-ium-1-ylcyclohexa-1,5-dien-1-yl)-4-nitrobenzohydrazide Traditional Name: N'-(3,3-dimethyl-5-pyrrolidin-1-ium-1-yl-cyclohexa-1,5-dien-1-yl)-4-nitro-benzohydrazide Formula: C19H25N4O3+ MolecularWeight: 357.4268

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=CC(=C1)NNC(=O)C2=CC=C(C=C2)[N+](=O)[O-])[NH+]3CCCC3)C

Isomeric SMILES

CC1(CC(=CC(=C1)NNC(=O)C2=CC=C(C=C2)[N+](=O)[O-])[NH+]3CCCC3)C

InChI

InChI=1S/C19H24N4O3/c1-19(2)12-15(11-17(13-19)22-9-3-4-10-22)20-21-18(24)14-5-7-16(8-6-14)23(25)26/h5-8,11-12,20H,3-4,9-10,13H2,1-2H3,(H,21,24)/p+1