4-(4-chloranyl-2-nitro-phenoxy)-N-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]benzamide

Systemtic Name: 4-(4-chloranyl-2-nitro-phenoxy)-N-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]benzamide Openeye Name: 4-(4-chloro-2-nitro-phenoxy)-N-[2-(isopropylamino)-2-oxo-ethyl]benzamide CAS Name: 4-(4-chloro-2-nitrophenoxy)-N-[2-oxo-2-(propan-2-ylamino)ethyl]benzamide IUPAC Name: 4-(4-chloro-2-nitrophenoxy)-N-[2-oxo-2-(propan-2-ylamino)ethyl]benzamide Traditional Name: 4-(4-chloro-2-nitro-phenoxy)-N-[2-(isopropylamino)-2-keto-ethyl]benzamide Formula: C18H18ClN3O5 MolecularWeight: 391.80562

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CNC(=O)C1=CC=C(C=C1)OC2=C(C=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CC(C)NC(=O)CNC(=O)C1=CC=C(C=C1)OC2=C(C=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H18ClN3O5/c1-11(2)21-17(23)10-20-18(24)12-3-6-14(7-4-12)27-16-8-5-13(19)9-15(16)22(25)26/h3-9,11H,10H2,1-2H3,(H,20,24)(H,21,23)