[(1S)-2-[(3-methoxyphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]-(pyridin-2-ylmethyl)azanium

Systemtic Name: [(1S)-2-[(3-methoxyphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]-(pyridin-2-ylmethyl)azanium Openeye Name: [(1S)-2-(3-methoxyanilino)-2-oxo-1-phenyl-ethyl]-(2-pyridylmethyl)ammonium CAS Name: [(1S)-2-(3-methoxyanilino)-2-oxo-1-phenylethyl]-(2-pyridinylmethyl)ammonium IUPAC Name: [(1S)-2-(3-methoxyanilino)-2-oxo-1-phenylethyl]-(pyridin-2-ylmethyl)azanium Traditional Name: [(1S)-2-keto-2-(m-anisidino)-1-phenyl-ethyl]-(2-pyridylmethyl)ammonium Formula: C21H22N3O2+ MolecularWeight: 348.41828

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=O)C(C2=CC=CC=C2)[NH2+]CC3=CC=CC=N3

Isomeric SMILES

COC1=CC=CC(=C1)NC(=O)[C@H](C2=CC=CC=C2)[NH2+]CC3=CC=CC=N3

InChI

InChI=1S/C21H21N3O2/c1-26-19-12-7-11-17(14-19)24-21(25)20(16-8-3-2-4-9-16)23-15-18-10-5-6-13-22-18/h2-14,20,23H,15H2,1H3,(H,24,25)/p+1/t20-/m0/s1