[(2S)-1-[(2-ethoxyphenyl)amino]-1-oxidanylidene-propan-2-yl]-methyl-(2-phenoxyethyl)azanium

Systemtic Name: [(2S)-1-[(2-ethoxyphenyl)amino]-1-oxidanylidene-propan-2-yl]-methyl-(2-phenoxyethyl)azanium Openeye Name: [(1S)-2-(2-ethoxyanilino)-1-methyl-2-oxo-ethyl]-methyl-(2-phenoxyethyl)ammonium CAS Name: [(2S)-1-(2-ethoxyanilino)-1-oxopropan-2-yl]-methyl-(2-phenoxyethyl)ammonium IUPAC Name: [(2S)-1-(2-ethoxyanilino)-1-oxopropan-2-yl]-methyl-(2-phenoxyethyl)azanium Traditional Name: [(1S)-2-keto-1-methyl-2-(o-phenetidino)ethyl]-methyl-(2-phenoxyethyl)ammonium Formula: C20H27N2O3+ MolecularWeight: 343.43998

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=O)C(C)[NH+](C)CCOC2=CC=CC=C2

Isomeric SMILES

CCOC1=CC=CC=C1NC(=O)[C@H](C)[NH+](C)CCOC2=CC=CC=C2

InChI

InChI=1S/C20H26N2O3/c1-4-24-19-13-9-8-12-18(19)21-20(23)16(2)22(3)14-15-25-17-10-6-5-7-11-17/h5-13,16H,4,14-15H2,1-3H3,(H,21,23)/p+1/t16-/m0/s1