[(3S)-3-methylpiperidin-1-yl]-[5-(pyrrolidin-1-ium-1-ylmethyl)furan-2-yl]methanone

Systemtic Name: [(3S)-3-methylpiperidin-1-yl]-[5-(pyrrolidin-1-ium-1-ylmethyl)furan-2-yl]methanone Openeye Name: [(3S)-3-methyl-1-piperidyl]-[5-(pyrrolidin-1-ium-1-ylmethyl)-2-furyl]methanone CAS Name: [(3S)-3-methyl-1-piperidinyl]-[5-(1-pyrrolidin-1-iumylmethyl)-2-furanyl]methanone IUPAC Name: [(3S)-3-methylpiperidin-1-yl]-[5-(pyrrolidin-1-ium-1-ylmethyl)furan-2-yl]methanone Traditional Name: [(3S)-3-methylpiperidino]-[5-(pyrrolidin-1-ium-1-ylmethyl)-2-furyl]methanone Formula: C16H25N2O2+ MolecularWeight: 277.3819

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=O)C2=CC=C(O2)C[NH+]3CCCC3

Isomeric SMILES

C[C@H]1CCCN(C1)C(=O)C2=CC=C(O2)C[NH+]3CCCC3

InChI

InChI=1S/C16H24N2O2/c1-13-5-4-10-18(11-13)16(19)15-7-6-14(20-15)12-17-8-2-3-9-17/h6-7,13H,2-5,8-12H2,1H3/p+1/t13-/m0/s1