[(3R)-3-[(4-fluorophenyl)amino]piperidin-1-yl]-(1-propan-2-ylpiperidin-1-ium-4-yl)methanone

Systemtic Name: [(3R)-3-[(4-fluorophenyl)amino]piperidin-1-yl]-(1-propan-2-ylpiperidin-1-ium-4-yl)methanone Openeye Name: [(3R)-3-(4-fluoroanilino)-1-piperidyl]-(1-isopropylpiperidin-1-ium-4-yl)methanone CAS Name: [(3R)-3-(4-fluoroanilino)-1-piperidinyl]-(1-propan-2-yl-4-piperidin-1-iumyl)methanone IUPAC Name: [(3R)-3-(4-fluoroanilino)piperidin-1-yl]-(1-propan-2-ylpiperidin-1-ium-4-yl)methanone Traditional Name: [(3R)-3-(4-fluoroanilino)piperidino]-(1-isopropylpiperidin-1-ium-4-yl)methanone Formula: C20H31FN3O+ MolecularWeight: 348.478043

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CCC(CC1)C(=O)N2CCCC(C2)NC3=CC=C(C=C3)F

Isomeric SMILES

CC(C)[NH+]1CCC(CC1)C(=O)N2CCC[C@H](C2)NC3=CC=C(C=C3)F

InChI

InChI=1S/C20H30FN3O/c1-15(2)23-12-9-16(10-13-23)20(25)24-11-3-4-19(14-24)22-18-7-5-17(21)6-8-18/h5-8,15-16,19,22H,3-4,9-14H2,1-2H3/p+1/t19-/m1/s1