(2S)-2-(5-chloranyl-2-oxidanylidene-pyridin-1-yl)-N-(2-dimethylaminoethyl)-3-(3-nitrophenyl)-3-oxidanylidene-propanamide

Systemtic Name: (2S)-2-(5-chloranyl-2-oxidanylidene-pyridin-1-yl)-N-(2-dimethylaminoethyl)-3-(3-nitrophenyl)-3-oxidanylidene-propanamide Openeye Name: (2S)-2-(5-chloro-2-oxo-1-pyridyl)-N-(2-dimethylaminoethyl)-3-(3-nitrophenyl)-3-oxo-propanamide CAS Name: (2S)-2-(5-chloro-2-oxo-1-pyridinyl)-N-(2-dimethylaminoethyl)-3-(3-nitrophenyl)-3-oxopropanamide IUPAC Name: (2S)-2-(5-chloro-2-oxopyridin-1-yl)-N-(2-dimethylaminoethyl)-3-(3-nitrophenyl)-3-oxopropanamide Traditional Name: (2S)-2-(5-chloro-2-keto-1-pyridyl)-N-(2-dimethylaminoethyl)-3-keto-3-(3-nitrophenyl)propionamide Formula: C18H19ClN4O5 MolecularWeight: 406.82026

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNC(=O)C(C(=O)C1=CC(=CC=C1)[N+](=O)[O-])N2C=C(C=CC2=O)Cl

Isomeric SMILES

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

InChI

InChI=1S/C18H19ClN4O5/c1-21(2)9-8-20-18(26)16(22-11-13(19)6-7-15(22)24)17(25)12-4-3-5-14(10-12)23(27)28/h3-7,10-11,16H,8-9H2,1-2H3,(H,20,26)/t16-/m0/s1