ethyl-[2-(ethylamino)-2-oxidanylidene-ethyl]-[(5-phenyl-1,2-oxazol-3-yl)methyl]azanium

Systemtic Name: ethyl-[2-(ethylamino)-2-oxidanylidene-ethyl]-[(5-phenyl-1,2-oxazol-3-yl)methyl]azanium Openeye Name: ethyl-[2-(ethylamino)-2-oxo-ethyl]-[(5-phenylisoxazol-3-yl)methyl]ammonium CAS Name: ethyl-[2-(ethylamino)-2-oxoethyl]-[(5-phenyl-3-isoxazolyl)methyl]ammonium IUPAC Name: ethyl-[2-(ethylamino)-2-oxoethyl]-[(5-phenyl-1,2-oxazol-3-yl)methyl]azanium Traditional Name: ethyl-[2-(ethylamino)-2-keto-ethyl]-[(5-phenylisoxazol-3-yl)methyl]ammonium Formula: C16H22N3O2+ MolecularWeight: 288.36478

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C[NH+](CC)CC1=NOC(=C1)C2=CC=CC=C2

Isomeric SMILES

CCNC(=O)C[NH+](CC)CC1=NOC(=C1)C2=CC=CC=C2

InChI

InChI=1S/C16H21N3O2/c1-3-17-16(20)12-19(4-2)11-14-10-15(21-18-14)13-8-6-5-7-9-13/h5-10H,3-4,11-12H2,1-2H3,(H,17,20)/p+1