2-[4-[3-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]carbonylpiperazin-1-ium-1-yl]-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-[4-[3-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]carbonylpiperazin-1-ium-1-yl]-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[4-[3-[(3,5-dimethylisoxazol-4-yl)methoxy]benzoyl]piperazin-1-ium-1-yl]-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[4-[[3-[(3,5-dimethyl-4-isoxazolyl)methoxy]phenyl]-oxomethyl]-1-piperazin-1-iumyl]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[4-[3-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzoyl]piperazin-1-ium-1-yl]-1-pyrrolidin-1-ylethanone Traditional Name: 2-[4-[3-[(3,5-dimethylisoxazol-4-yl)methoxy]benzoyl]piperazin-1-ium-1-yl]-1-pyrrolidino-ethanone Formula: C23H31N4O4+ MolecularWeight: 427.51664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)COC2=CC=CC(=C2)C(=O)N3CC[NH+](CC3)CC(=O)N4CCCC4

Isomeric SMILES

CC1=C(C(=NO1)C)COC2=CC=CC(=C2)C(=O)N3CC[NH+](CC3)CC(=O)N4CCCC4

InChI

InChI=1S/C23H30N4O4/c1-17-21(18(2)31-24-17)16-30-20-7-5-6-19(14-20)23(29)27-12-10-25(11-13-27)15-22(28)26-8-3-4-9-26/h5-7,14H,3-4,8-13,15-16H2,1-2H3/p+1