1-[4-[2-[(3R)-3-methylpiperazin-4-ium-1-yl]ethoxy]phenyl]propan-1-one

Systemtic Name: 1-[4-[2-[(3R)-3-methylpiperazin-4-ium-1-yl]ethoxy]phenyl]propan-1-one Openeye Name: 1-[4-[2-[(3R)-3-methylpiperazin-4-ium-1-yl]ethoxy]phenyl]propan-1-one CAS Name: 1-[4-[2-[(3R)-3-methyl-1-piperazin-4-iumyl]ethoxy]phenyl]-1-propanone IUPAC Name: 1-[4-[2-[(3R)-3-methylpiperazin-4-ium-1-yl]ethoxy]phenyl]propan-1-one Traditional Name: 1-[4-[2-[(3R)-3-methylpiperazin-4-ium-1-yl]ethoxy]phenyl]propan-1-one Formula: C16H25N2O2+ MolecularWeight: 277.3819

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC=C(C=C1)OCCN2CC[NH2+]C(C2)C

Isomeric SMILES

CCC(=O)C1=CC=C(C=C1)OCCN2CC[NH2+][C@@H](C2)C

InChI

InChI=1S/C16H24N2O2/c1-3-16(19)14-4-6-15(7-5-14)20-11-10-18-9-8-17-13(2)12-18/h4-7,13,17H,3,8-12H2,1-2H3/p+1/t13-/m1/s1