4-[4-(3-morpholin-4-ium-4-ylpropoxy)phenyl]butan-2-one

Systemtic Name: 4-[4-(3-morpholin-4-ium-4-ylpropoxy)phenyl]butan-2-one Openeye Name: 4-[4-(3-morpholin-4-ium-4-ylpropoxy)phenyl]butan-2-one CAS Name: 4-[4-[3-(4-morpholin-4-iumyl)propoxy]phenyl]-2-butanone IUPAC Name: 4-[4-(3-morpholin-4-ium-4-ylpropoxy)phenyl]butan-2-one Traditional Name: 4-[4-(3-morpholin-4-ium-4-ylpropoxy)phenyl]butan-2-one Formula: C17H26NO3+ MolecularWeight: 292.39324

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC1=CC=C(C=C1)OCCC[NH+]2CCOCC2

Isomeric SMILES

CC(=O)CCC1=CC=C(C=C1)OCCC[NH+]2CCOCC2

InChI

InChI=1S/C17H25NO3/c1-15(19)3-4-16-5-7-17(8-6-16)21-12-2-9-18-10-13-20-14-11-18/h5-8H,2-4,9-14H2,1H3/p+1