(5-chloranyl-2-methoxy-phenyl)methyl-methyl-[2-oxidanylidene-2-[[(2R)-3-oxidanylidene-1-phenyl-butan-2-yl]amino]ethyl]azanium

Systemtic Name: (5-chloranyl-2-methoxy-phenyl)methyl-methyl-[2-oxidanylidene-2-[[(2R)-3-oxidanylidene-1-phenyl-butan-2-yl]amino]ethyl]azanium Openeye Name: [2-[[(1R)-1-benzyl-2-oxo-propyl]amino]-2-oxo-ethyl]-[(5-chloro-2-methoxy-phenyl)methyl]-methyl-ammonium CAS Name: (5-chloro-2-methoxyphenyl)methyl-methyl-[2-oxo-2-[[(2R)-3-oxo-1-phenylbutan-2-yl]amino]ethyl]ammonium IUPAC Name: (5-chloro-2-methoxyphenyl)methyl-methyl-[2-oxo-2-[[(2R)-3-oxo-1-phenylbutan-2-yl]amino]ethyl]azanium Traditional Name: [2-[[(1R)-1-benzyl-2-keto-propyl]amino]-2-keto-ethyl]-(5-chloro-2-methoxy-benzyl)-methyl-ammonium Formula: C21H26ClN2O3+ MolecularWeight: 389.89574

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(CC1=CC=CC=C1)NC(=O)C[NH+](C)CC2=C(C=CC(=C2)Cl)OC

Isomeric SMILES

CC(=O)[C@@H](CC1=CC=CC=C1)NC(=O)C[NH+](C)CC2=C(C=CC(=C2)Cl)OC

InChI

InChI=1S/C21H25ClN2O3/c1-15(25)19(11-16-7-5-4-6-8-16)23-21(26)14-24(2)13-17-12-18(22)9-10-20(17)27-3/h4-10,12,19H,11,13-14H2,1-3H3,(H,23,26)/p+1/t19-/m1/s1