4-[(S)-(2-methoxyphenyl)-pyrrolidin-1-ium-1-yl-methyl]piperidin-1-ium

Systemtic Name: 4-[(S)-(2-methoxyphenyl)-pyrrolidin-1-ium-1-yl-methyl]piperidin-1-ium Openeye Name: 4-[(S)-(2-methoxyphenyl)-pyrrolidin-1-ium-1-yl-methyl]piperidin-1-ium CAS Name: 4-[(S)-(2-methoxyphenyl)-(1-pyrrolidin-1-iumyl)methyl]piperidin-1-ium IUPAC Name: 4-[(S)-(2-methoxyphenyl)-pyrrolidin-1-ium-1-ylmethyl]piperidin-1-ium Traditional Name: 4-[(S)-(2-methoxyphenyl)-pyrrolidin-1-ium-1-yl-methyl]piperidin-1-ium Formula: C17H28N2O+2 MolecularWeight: 276.41702

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(C2CC[NH2+]CC2)[NH+]3CCCC3

Isomeric SMILES

COC1=CC=CC=C1[C@H](C2CC[NH2+]CC2)[NH+]3CCCC3

InChI

InChI=1S/C17H26N2O/c1-20-16-7-3-2-6-15(16)17(19-12-4-5-13-19)14-8-10-18-11-9-14/h2-3,6-7,14,17-18H,4-5,8-13H2,1H3/p+2/t17-/m0/s1