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

Systemtic Name: 2-(4-methoxyphenyl)ethyl-[(1S)-2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxidanylidene-1-phenyl-ethyl]azanium Openeye Name: 2-(4-methoxyphenyl)ethyl-[(1S)-2-[(5-methylisoxazol-3-yl)amino]-2-oxo-1-phenyl-ethyl]ammonium CAS Name: 2-(4-methoxyphenyl)ethyl-[(1S)-2-[(5-methyl-3-isoxazolyl)amino]-2-oxo-1-phenylethyl]ammonium IUPAC Name: 2-(4-methoxyphenyl)ethyl-[(1S)-2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxo-1-phenylethyl]azanium Traditional Name: [(1S)-2-keto-2-[(5-methylisoxazol-3-yl)amino]-1-phenyl-ethyl]-[2-(4-methoxyphenyl)ethyl]ammonium Formula: C21H24N3O3+ MolecularWeight: 366.43356

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)C(C2=CC=CC=C2)[NH2+]CCC3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC(=NO1)NC(=O)[C@H](C2=CC=CC=C2)[NH2+]CCC3=CC=C(C=C3)OC

InChI

InChI=1S/C21H23N3O3/c1-15-14-19(24-27-15)23-21(25)20(17-6-4-3-5-7-17)22-13-12-16-8-10-18(26-2)11-9-16/h3-11,14,20,22H,12-13H2,1-2H3,(H,23,24,25)/p+1/t20-/m0/s1