1-[[4-(2-pyrrolidin-1-ium-1-ylethoxy)phenyl]methyl]piperidin-1-ium-4-amine

Systemtic Name: 1-[[4-(2-pyrrolidin-1-ium-1-ylethoxy)phenyl]methyl]piperidin-1-ium-4-amine Openeye Name: 1-[[4-(2-pyrrolidin-1-ium-1-ylethoxy)phenyl]methyl]piperidin-1-ium-4-amine CAS Name: 1-[[4-[2-(1-pyrrolidin-1-iumyl)ethoxy]phenyl]methyl]-4-piperidin-1-iumamine IUPAC Name: 1-[[4-(2-pyrrolidin-1-ium-1-ylethoxy)phenyl]methyl]piperidin-1-ium-4-amine Traditional Name: [1-[4-(2-pyrrolidin-1-ium-1-ylethoxy)benzyl]piperidin-1-ium-4-yl]amine Formula: C18H31N3O+2 MolecularWeight: 305.45824

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CCOC2=CC=C(C=C2)C[NH+]3CCC(CC3)N

Isomeric SMILES

C1CC[NH+](C1)CCOC2=CC=C(C=C2)C[NH+]3CCC(CC3)N

InChI

InChI=1S/C18H29N3O/c19-17-7-11-21(12-8-17)15-16-3-5-18(6-4-16)22-14-13-20-9-1-2-10-20/h3-6,17H,1-2,7-15,19H2/p+2