methyl-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]-[(5-phenyl-1,2-oxazol-3-yl)methyl]azanium

Systemtic Name: methyl-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]-[(5-phenyl-1,2-oxazol-3-yl)methyl]azanium Openeye Name: methyl-[2-(4-methylanilino)-2-oxo-ethyl]-[(5-phenylisoxazol-3-yl)methyl]ammonium CAS Name: methyl-[2-(4-methylanilino)-2-oxoethyl]-[(5-phenyl-3-isoxazolyl)methyl]ammonium IUPAC Name: methyl-[2-(4-methylanilino)-2-oxoethyl]-[(5-phenyl-1,2-oxazol-3-yl)methyl]azanium Traditional Name: [2-keto-2-(p-toluidino)ethyl]-methyl-[(5-phenylisoxazol-3-yl)methyl]ammonium Formula: C20H22N3O2+ MolecularWeight: 336.40758

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C[NH+](C)CC2=NOC(=C2)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C[NH+](C)CC2=NOC(=C2)C3=CC=CC=C3

InChI

InChI=1S/C20H21N3O2/c1-15-8-10-17(11-9-15)21-20(24)14-23(2)13-18-12-19(25-22-18)16-6-4-3-5-7-16/h3-12H,13-14H2,1-2H3,(H,21,24)/p+1