[(1R)-2-[(2-ethoxyphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]-(3-imidazol-1-ylpropyl)azanium

Systemtic Name: [(1R)-2-[(2-ethoxyphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]-(3-imidazol-1-ylpropyl)azanium Openeye Name: [(1R)-2-(2-ethoxyanilino)-2-oxo-1-phenyl-ethyl]-(3-imidazol-1-ylpropyl)ammonium CAS Name: [(1R)-2-(2-ethoxyanilino)-2-oxo-1-phenylethyl]-[3-(1-imidazolyl)propyl]ammonium IUPAC Name: [(1R)-2-(2-ethoxyanilino)-2-oxo-1-phenylethyl]-(3-imidazol-1-ylpropyl)azanium Traditional Name: 3-imidazol-1-ylpropyl-[(1R)-2-keto-2-(o-phenetidino)-1-phenyl-ethyl]ammonium Formula: C22H27N4O2+ MolecularWeight: 379.47538

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=O)C(C2=CC=CC=C2)[NH2+]CCCN3C=CN=C3

Isomeric SMILES

CCOC1=CC=CC=C1NC(=O)[C@@H](C2=CC=CC=C2)[NH2+]CCCN3C=CN=C3

InChI

InChI=1S/C22H26N4O2/c1-2-28-20-12-7-6-11-19(20)25-22(27)21(18-9-4-3-5-10-18)24-13-8-15-26-16-14-23-17-26/h3-7,9-12,14,16-17,21,24H,2,8,13,15H2,1H3,(H,25,27)/p+1/t21-/m1/s1