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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC1C2=CC=C(O2)CNC3CC[NH+](CC3)C(C)C

Isomeric SMILES

C[C@@H]1C[C@@H]1C2=CC=C(O2)CNC3CC[NH+](CC3)C(C)C

InChI

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