4-chloranyl-N-[(Z)-[2-(methylamino)-1-nitro-2-pyrrolidin-1-ium-1-ylidene-ethylidene]amino]aniline

Systemtic Name: 4-chloranyl-N-[(Z)-[2-(methylamino)-1-nitro-2-pyrrolidin-1-ium-1-ylidene-ethylidene]amino]aniline Openeye Name: 4-chloro-N-[(Z)-[2-(methylamino)-1-nitro-2-pyrrolidin-1-ium-1-ylidene-ethylidene]amino]aniline CAS Name: 4-chloro-N-[(Z)-[2-(methylamino)-1-nitro-2-(1-pyrrolidin-1-iumylidene)ethylidene]amino]aniline IUPAC Name: 4-chloro-N-[(Z)-[2-(methylamino)-1-nitro-2-pyrrolidin-1-ium-1-ylideneethylidene]amino]aniline Traditional Name: (4-chlorophenyl)-[(Z)-[2-(methylamino)-1-nitro-2-pyrrolidin-1-ium-1-ylidene-ethylidene]amino]amine Formula: C13H17ClN5O2+ MolecularWeight: 310.75938

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=[N+]1CCCC1)C(=NNC2=CC=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CNC(=[N+]1CCCC1)/C(=N/NC2=CC=C(C=C2)Cl)/[N+](=O)[O-]

InChI

InChI=1S/C13H16ClN5O2/c1-15-12(18-8-2-3-9-18)13(19(20)21)17-16-11-6-4-10(14)5-7-11/h4-7H,2-3,8-9H2,1H3,(H,15,16)/p+1