2-[[(2S)-2-(5-chloranyl-2-oxidanylidene-pyridin-1-yl)-3-oxidanylidene-3-phenyl-propanoyl]amino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[(2S)-2-(5-chloranyl-2-oxidanylidene-pyridin-1-yl)-3-oxidanylidene-3-phenyl-propanoyl]amino]ethyl-dimethyl-azanium Openeye Name: 2-[[(2S)-2-(5-chloro-2-oxo-1-pyridyl)-3-oxo-3-phenyl-propanoyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[(2S)-2-(5-chloro-2-oxo-1-pyridinyl)-1,3-dioxo-3-phenylpropyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[(2S)-2-(5-chloro-2-oxopyridin-1-yl)-3-oxo-3-phenylpropanoyl]amino]ethyl-dimethylazanium Traditional Name: 2-[[(2S)-2-(5-chloro-2-keto-1-pyridyl)-3-keto-3-phenyl-propanoyl]amino]ethyl-dimethyl-ammonium Formula: C18H21ClN3O3+ MolecularWeight: 362.83064

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNC(=O)C(C(=O)C1=CC=CC=C1)N2C=C(C=CC2=O)Cl

Isomeric SMILES

C[NH+](C)CCNC(=O)[C@H](C(=O)C1=CC=CC=C1)N2C=C(C=CC2=O)Cl

InChI

InChI=1S/C18H20ClN3O3/c1-21(2)11-10-20-18(25)16(17(24)13-6-4-3-5-7-13)22-12-14(19)8-9-15(22)23/h3-9,12,16H,10-11H2,1-2H3,(H,20,25)/p+1/t16-/m0/s1