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

Systemtic Name: [(1R)-2-[(3-chloranyl-5-methoxy-4-propoxy-phenyl)carbonylamino]-1-phenyl-ethyl]-dimethyl-azanium Openeye Name: [(1R)-2-[(3-chloro-5-methoxy-4-propoxy-benzoyl)amino]-1-phenyl-ethyl]-dimethyl-ammonium CAS Name: [(1R)-2-[[(3-chloro-5-methoxy-4-propoxyphenyl)-oxomethyl]amino]-1-phenylethyl]-dimethylammonium IUPAC Name: [(1R)-2-[(3-chloro-5-methoxy-4-propoxybenzoyl)amino]-1-phenylethyl]-dimethylazanium Traditional Name: [(1R)-2-[(3-chloro-5-methoxy-4-propoxy-benzoyl)amino]-1-phenyl-ethyl]-dimethyl-ammonium Formula: C21H28ClN2O3+ MolecularWeight: 391.91162

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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)OC

Isomeric SMILES

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

InChI

InChI=1S/C21H27ClN2O3/c1-5-11-27-20-17(22)12-16(13-19(20)26-4)21(25)23-14-18(24(2)3)15-9-7-6-8-10-15/h6-10,12-13,18H,5,11,14H2,1-4H3,(H,23,25)/p+1/t18-/m0/s1