[2-[4-(4-cyano-2-methyl-1,3-oxazol-5-yl)piperazin-1-yl]-2-oxidanylidene-ethyl]-methyl-(naphthalen-2-ylmethyl)azanium

Systemtic Name: [2-[4-(4-cyano-2-methyl-1,3-oxazol-5-yl)piperazin-1-yl]-2-oxidanylidene-ethyl]-methyl-(naphthalen-2-ylmethyl)azanium Openeye Name: [2-[4-(4-cyano-2-methyl-oxazol-5-yl)piperazin-1-yl]-2-oxo-ethyl]-methyl-(2-naphthylmethyl)ammonium CAS Name: [2-[4-(4-cyano-2-methyl-5-oxazolyl)-1-piperazinyl]-2-oxoethyl]-methyl-(2-naphthalenylmethyl)ammonium IUPAC Name: [2-[4-(4-cyano-2-methyl-1,3-oxazol-5-yl)piperazin-1-yl]-2-oxoethyl]-methyl-(naphthalen-2-ylmethyl)azanium Traditional Name: [2-[4-(4-cyano-2-methyl-oxazol-5-yl)piperazino]-2-keto-ethyl]-methyl-(2-naphthylmethyl)ammonium Formula: C23H26N5O2+ MolecularWeight: 404.48484

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(O1)N2CCN(CC2)C(=O)C[NH+](C)CC3=CC4=CC=CC=C4C=C3)C#N

Isomeric SMILES

CC1=NC(=C(O1)N2CCN(CC2)C(=O)C[NH+](C)CC3=CC4=CC=CC=C4C=C3)C#N

InChI

InChI=1S/C23H25N5O2/c1-17-25-21(14-24)23(30-17)28-11-9-27(10-12-28)22(29)16-26(2)15-18-7-8-19-5-3-4-6-20(19)13-18/h3-8,13H,9-12,15-16H2,1-2H3/p+1