N-[[1-[2,3-bis(chloranyl)phenyl]pyrrol-2-yl]methyl]-2-pyrrolidin-1-ium-1-yl-ethanamine

Systemtic Name: N-[[1-[2,3-bis(chloranyl)phenyl]pyrrol-2-yl]methyl]-2-pyrrolidin-1-ium-1-yl-ethanamine Openeye Name: N-[[1-(2,3-dichlorophenyl)pyrrol-2-yl]methyl]-2-pyrrolidin-1-ium-1-yl-ethanamine CAS Name: N-[[1-(2,3-dichlorophenyl)-2-pyrrolyl]methyl]-2-(1-pyrrolidin-1-iumyl)ethanamine IUPAC Name: N-[[1-(2,3-dichlorophenyl)pyrrol-2-yl]methyl]-2-pyrrolidin-1-ium-1-ylethanamine Traditional Name: [1-(2,3-dichlorophenyl)pyrrol-2-yl]methyl-(2-pyrrolidin-1-ium-1-ylethyl)amine Formula: C17H22Cl2N3+ MolecularWeight: 339.28268

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CCNCC2=CC=CN2C3=C(C(=CC=C3)Cl)Cl

Isomeric SMILES

C1CC[NH+](C1)CCNCC2=CC=CN2C3=C(C(=CC=C3)Cl)Cl

InChI

InChI=1S/C17H21Cl2N3/c18-15-6-3-7-16(17(15)19)22-11-4-5-14(22)13-20-8-12-21-9-1-2-10-21/h3-7,11,20H,1-2,8-10,12-13H2/p+1