[2-[(3-tert-butyl-1,2-oxazol-5-yl)amino]-2-oxidanylidene-ethyl]-methyl-[(4-propan-2-ylphenyl)methyl]azanium

Systemtic Name: [2-[(3-tert-butyl-1,2-oxazol-5-yl)amino]-2-oxidanylidene-ethyl]-methyl-[(4-propan-2-ylphenyl)methyl]azanium Openeye Name: [2-[(3-tert-butylisoxazol-5-yl)amino]-2-oxo-ethyl]-[(4-isopropylphenyl)methyl]-methyl-ammonium CAS Name: [2-[(3-tert-butyl-5-isoxazolyl)amino]-2-oxoethyl]-methyl-[(4-propan-2-ylphenyl)methyl]ammonium IUPAC Name: [2-[(3-tert-butyl-1,2-oxazol-5-yl)amino]-2-oxoethyl]-methyl-[(4-propan-2-ylphenyl)methyl]azanium Traditional Name: [2-[(3-tert-butylisoxazol-5-yl)amino]-2-keto-ethyl]-(4-isopropylbenzyl)-methyl-ammonium Formula: C20H30N3O2+ MolecularWeight: 344.4711

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C[NH+](C)CC(=O)NC2=CC(=NO2)C(C)(C)C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C[NH+](C)CC(=O)NC2=CC(=NO2)C(C)(C)C

InChI

InChI=1S/C20H29N3O2/c1-14(2)16-9-7-15(8-10-16)12-23(6)13-18(24)21-19-11-17(22-25-19)20(3,4)5/h7-11,14H,12-13H2,1-6H3,(H,21,24)/p+1