4-chloranyl-N-[3-[[2-(4-nitrophenyl)-2-oxidanyl-ethyl]amino]-3-oxidanylidene-propyl]benzamide

Systemtic Name: 4-chloranyl-N-[3-[[2-(4-nitrophenyl)-2-oxidanyl-ethyl]amino]-3-oxidanylidene-propyl]benzamide Openeye Name: 4-chloro-N-[3-[[2-hydroxy-2-(4-nitrophenyl)ethyl]amino]-3-oxo-propyl]benzamide CAS Name: 4-chloro-N-[3-[[2-hydroxy-2-(4-nitrophenyl)ethyl]amino]-3-oxopropyl]benzamide IUPAC Name: 4-chloro-N-[3-[[2-hydroxy-2-(4-nitrophenyl)ethyl]amino]-3-oxopropyl]benzamide Traditional Name: 4-chloro-N-[3-[[2-hydroxy-2-(4-nitrophenyl)ethyl]amino]-3-keto-propyl]benzamide Formula: C18H18ClN3O5 MolecularWeight: 391.80562

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(CNC(=O)CCNC(=O)C2=CC=C(C=C2)Cl)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(CNC(=O)CCNC(=O)C2=CC=C(C=C2)Cl)O)[N+](=O)[O-]

InChI

InChI=1S/C18H18ClN3O5/c19-14-5-1-13(2-6-14)18(25)20-10-9-17(24)21-11-16(23)12-3-7-15(8-4-12)22(26)27/h1-8,16,23H,9-11H2,(H,20,25)(H,21,24)