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

Systemtic Name: (2-methoxy-5-methyl-phenyl)methyl-methyl-[(1S)-2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxidanylidene-1-phenyl-ethyl]azanium Openeye Name: (2-methoxy-5-methyl-phenyl)methyl-methyl-[(1S)-2-[(5-methylisoxazol-3-yl)amino]-2-oxo-1-phenyl-ethyl]ammonium CAS Name: (2-methoxy-5-methylphenyl)methyl-methyl-[(1S)-2-[(5-methyl-3-isoxazolyl)amino]-2-oxo-1-phenylethyl]ammonium IUPAC Name: (2-methoxy-5-methylphenyl)methyl-methyl-[(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-methoxy-5-methyl-benzyl)-methyl-ammonium Formula: C22H26N3O3+ MolecularWeight: 380.46014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)C[NH+](C)C(C2=CC=CC=C2)C(=O)NC3=NOC(=C3)C

Isomeric SMILES

CC1=CC(=C(C=C1)OC)C[NH+](C)[C@@H](C2=CC=CC=C2)C(=O)NC3=NOC(=C3)C

InChI

InChI=1S/C22H25N3O3/c1-15-10-11-19(27-4)18(12-15)14-25(3)21(17-8-6-5-7-9-17)22(26)23-20-13-16(2)28-24-20/h5-13,21H,14H2,1-4H3,(H,23,24,26)/p+1/t21-/m0/s1