1-[4-(2-morpholin-4-ium-4-ylethyl)-1-phenyl-piperidin-4-yl]butan-1-one dichloride

Systemtic Name: 1-[4-(2-morpholin-4-ium-4-ylethyl)-1-phenyl-piperidin-4-yl]butan-1-one dichloride Openeye Name: 1-[4-(2-morpholin-4-ium-4-ylethyl)-1-phenyl-4-piperidyl]butan-1-one dichloride CAS Name: 1-[4-[2-(4-morpholin-4-iumyl)ethyl]-1-phenyl-4-piperidinyl]-1-butanone dichloride IUPAC Name: 1-[4-(2-morpholin-4-ium-4-ylethyl)-1-phenylpiperidin-4-yl]butan-1-one dichloride Traditional Name: 1-[4-(2-morpholin-4-ium-4-ylethyl)-1-phenyl-4-piperidyl]butan-1-one dichloride Formula: C21H33Cl2N2O2- MolecularWeight: 416.40492

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1(CCN(CC1)C2=CC=CC=C2)CC[NH+]3CCOCC3.[Cl-].[Cl-]

Isomeric SMILES

CCCC(=O)C1(CCN(CC1)C2=CC=CC=C2)CC[NH+]3CCOCC3.[Cl-].[Cl-]

InChI

InChI=1S/C21H32N2O2.2ClH/c1-2-6-20(24)21(9-12-22-15-17-25-18-16-22)10-13-23(14-11-21)19-7-4-3-5-8-19;;/h3-5,7-8H,2,6,9-18H2,1H3;2*1H/p-1