[(1R)-2-[(3-chloranyl-5-ethoxy-4-propoxy-phenyl)carbonylamino]-1-phenyl-ethyl]-dimethyl-azanium

Systemtic Name: [(1R)-2-[(3-chloranyl-5-ethoxy-4-propoxy-phenyl)carbonylamino]-1-phenyl-ethyl]-dimethyl-azanium Openeye Name: [(1R)-2-[(3-chloro-5-ethoxy-4-propoxy-benzoyl)amino]-1-phenyl-ethyl]-dimethyl-ammonium CAS Name: [(1R)-2-[[(3-chloro-5-ethoxy-4-propoxyphenyl)-oxomethyl]amino]-1-phenylethyl]-dimethylammonium IUPAC Name: [(1R)-2-[(3-chloro-5-ethoxy-4-propoxybenzoyl)amino]-1-phenylethyl]-dimethylazanium Traditional Name: [(1R)-2-[(3-chloro-5-ethoxy-4-propoxy-benzoyl)amino]-1-phenyl-ethyl]-dimethyl-ammonium Formula: C22H30ClN2O3+ MolecularWeight: 405.9382

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1Cl)C(=O)NCC(C2=CC=CC=C2)[NH+](C)C)OCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1Cl)C(=O)NC[C@@H](C2=CC=CC=C2)[NH+](C)C)OCC

InChI

InChI=1S/C22H29ClN2O3/c1-5-12-28-21-18(23)13-17(14-20(21)27-6-2)22(26)24-15-19(25(3)4)16-10-8-7-9-11-16/h7-11,13-14,19H,5-6,12,15H2,1-4H3,(H,24,26)/p+1/t19-/m0/s1