1-[2,3-bis(chloranyl)-4-[[3-(4-nitrophenyl)-1,2,4-oxadiazol-5-yl]methoxy]phenyl]-2-methylidene-butan-1-one

Systemtic Name: 1-[2,3-bis(chloranyl)-4-[[3-(4-nitrophenyl)-1,2,4-oxadiazol-5-yl]methoxy]phenyl]-2-methylidene-butan-1-one Openeye Name: 1-[2,3-dichloro-4-[[3-(4-nitrophenyl)-1,2,4-oxadiazol-5-yl]methoxy]phenyl]-2-methylene-butan-1-one CAS Name: 1-[2,3-dichloro-4-[[3-(4-nitrophenyl)-1,2,4-oxadiazol-5-yl]methoxy]phenyl]-2-methylene-1-butanone IUPAC Name: 1-[2,3-dichloro-4-[[3-(4-nitrophenyl)-1,2,4-oxadiazol-5-yl]methoxy]phenyl]-2-methylidenebutan-1-one Traditional Name: 1-[2,3-dichloro-4-[[3-(4-nitrophenyl)-1,2,4-oxadiazol-5-yl]methoxy]phenyl]-2-ethyl-prop-2-en-1-one Formula: C20H15Cl2N3O5 MolecularWeight: 448.2562

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=C)C(=O)C1=C(C(=C(C=C1)OCC2=NC(=NO2)C3=CC=C(C=C3)[N+](=O)[O-])Cl)Cl

Isomeric SMILES

CCC(=C)C(=O)C1=C(C(=C(C=C1)OCC2=NC(=NO2)C3=CC=C(C=C3)[N+](=O)[O-])Cl)Cl

InChI

InChI=1S/C20H15Cl2N3O5/c1-3-11(2)19(26)14-8-9-15(18(22)17(14)21)29-10-16-23-20(24-30-16)12-4-6-13(7-5-12)25(27)28/h4-9H,2-3,10H2,1H3