N-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]quinolin-1-ium-2-amine

Systemtic Name: N-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]quinolin-1-ium-2-amine Openeye Name: N-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]quinolin-1-ium-2-amine CAS Name: N-[[4-(1-pyrrolidin-1-iumylmethyl)phenyl]methyl]-2-quinolin-1-iumamine IUPAC Name: N-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]quinolin-1-ium-2-amine Traditional Name: [4-(pyrrolidin-1-ium-1-ylmethyl)benzyl]-quinolin-1-ium-2-yl-amine Formula: C21H25N3+2 MolecularWeight: 319.4433

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC2=CC=C(C=C2)CNC3=[NH+]C4=CC=CC=C4C=C3

Isomeric SMILES

C1CC[NH+](C1)CC2=CC=C(C=C2)CNC3=[NH+]C4=CC=CC=C4C=C3

InChI

InChI=1S/C21H23N3/c1-2-6-20-19(5-1)11-12-21(23-20)22-15-17-7-9-18(10-8-17)16-24-13-3-4-14-24/h1-2,5-12H,3-4,13-16H2,(H,22,23)/p+2