(4-chlorophenyl)-[(3R)-1-(1-ethylpiperidin-1-ium-4-yl)piperidin-1-ium-3-yl]methanone

Systemtic Name: (4-chlorophenyl)-[(3R)-1-(1-ethylpiperidin-1-ium-4-yl)piperidin-1-ium-3-yl]methanone Openeye Name: (4-chlorophenyl)-[(3R)-1-(1-ethylpiperidin-1-ium-4-yl)piperidin-1-ium-3-yl]methanone CAS Name: (4-chlorophenyl)-[(3R)-1-(1-ethyl-4-piperidin-1-iumyl)-3-piperidin-1-iumyl]methanone IUPAC Name: (4-chlorophenyl)-[(3R)-1-(1-ethylpiperidin-1-ium-4-yl)piperidin-1-ium-3-yl]methanone Traditional Name: (4-chlorophenyl)-[(3R)-1-(1-ethylpiperidin-1-ium-4-yl)piperidin-1-ium-3-yl]methanone Formula: C19H29ClN2O+2 MolecularWeight: 336.89936

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCC(CC1)[NH+]2CCCC(C2)C(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC[NH+]1CCC(CC1)[NH+]2CCC[C@H](C2)C(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H27ClN2O/c1-2-21-12-9-18(10-13-21)22-11-3-4-16(14-22)19(23)15-5-7-17(20)8-6-15/h5-8,16,18H,2-4,9-14H2,1H3/p+2/t16-/m1/s1