2-(4-chloranylphenoxy)ethyl-methyl-[(2R)-1-oxidanylidene-1-[(phenylmethyl)carbamoylamino]propan-2-yl]azanium

Systemtic Name: 2-(4-chloranylphenoxy)ethyl-methyl-[(2R)-1-oxidanylidene-1-[(phenylmethyl)carbamoylamino]propan-2-yl]azanium Openeye Name: [(1R)-2-(benzylcarbamoylamino)-1-methyl-2-oxo-ethyl]-[2-(4-chlorophenoxy)ethyl]-methyl-ammonium CAS Name: 2-(4-chlorophenoxy)ethyl-methyl-[(2R)-1-oxo-1-[[oxo-[(phenylmethyl)amino]methyl]amino]propan-2-yl]ammonium IUPAC Name: [(2R)-1-(benzylcarbamoylamino)-1-oxopropan-2-yl]-[2-(4-chlorophenoxy)ethyl]-methylazanium Traditional Name: [(1R)-2-(benzylcarbamoylamino)-2-keto-1-methyl-ethyl]-[2-(4-chlorophenoxy)ethyl]-methyl-ammonium Formula: C20H25ClN3O3+ MolecularWeight: 390.8838

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NCC1=CC=CC=C1)[NH+](C)CCOC2=CC=C(C=C2)Cl

Isomeric SMILES

C[C@H](C(=O)NC(=O)NCC1=CC=CC=C1)[NH+](C)CCOC2=CC=C(C=C2)Cl

InChI

InChI=1S/C20H24ClN3O3/c1-15(24(2)12-13-27-18-10-8-17(21)9-11-18)19(25)23-20(26)22-14-16-6-4-3-5-7-16/h3-11,15H,12-14H2,1-2H3,(H2,22,23,25,26)/p+1/t15-/m1/s1