2-[[4-chloranyl-2,5-bis(oxidanylidene)-1-(phenylmethyl)pyrrol-3-yl]amino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[4-chloranyl-2,5-bis(oxidanylidene)-1-(phenylmethyl)pyrrol-3-yl]amino]ethyl-dimethyl-azanium Openeye Name: 2-[(1-benzyl-4-chloro-2,5-dioxo-pyrrol-3-yl)amino]ethyl-dimethyl-ammonium CAS Name: 2-[[4-chloro-2,5-dioxo-1-(phenylmethyl)-3-pyrrolyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[(1-benzyl-4-chloro-2,5-dioxopyrrol-3-yl)amino]ethyl-dimethylazanium Traditional Name: 2-[(1-benzyl-4-chloro-2,5-diketo-3-pyrrolin-3-yl)amino]ethyl-dimethyl-ammonium Formula: C15H19ClN3O2+ MolecularWeight: 308.78326

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNC1=C(C(=O)N(C1=O)CC2=CC=CC=C2)Cl

Isomeric SMILES

C[NH+](C)CCNC1=C(C(=O)N(C1=O)CC2=CC=CC=C2)Cl

InChI

InChI=1S/C15H18ClN3O2/c1-18(2)9-8-17-13-12(16)14(20)19(15(13)21)10-11-6-4-3-5-7-11/h3-7,17H,8-10H2,1-2H3/p+1