N-[[5-[(1S,2R)-2-methylcyclopropyl]furan-2-yl]methyl]-1-propyl-piperidin-1-ium-4-amine

Systemtic Name: N-[[5-[(1S,2R)-2-methylcyclopropyl]furan-2-yl]methyl]-1-propyl-piperidin-1-ium-4-amine Openeye Name: N-[[5-[(1S,2R)-2-methylcyclopropyl]-2-furyl]methyl]-1-propyl-piperidin-1-ium-4-amine CAS Name: N-[[5-[(1S,2R)-2-methylcyclopropyl]-2-furanyl]methyl]-1-propyl-4-piperidin-1-iumamine IUPAC Name: N-[[5-[(1S,2R)-2-methylcyclopropyl]furan-2-yl]methyl]-1-propylpiperidin-1-ium-4-amine Traditional Name: [5-[(1S,2R)-2-methylcyclopropyl]-2-furyl]methyl-(1-propylpiperidin-1-ium-4-yl)amine Formula: C17H29N2O+ MolecularWeight: 277.42496

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCC(CC1)NCC2=CC=C(O2)C3CC3C

Isomeric SMILES

CCC[NH+]1CCC(CC1)NCC2=CC=C(O2)[C@H]3C[C@H]3C

InChI

InChI=1S/C17H28N2O/c1-3-8-19-9-6-14(7-10-19)18-12-15-4-5-17(20-15)16-11-13(16)2/h4-5,13-14,16,18H,3,6-12H2,1-2H3/p+1/t13-,16+/m1/s1