3-[(E)-3-(4-chlorophenyl)-1-(4-nitrophenyl)prop-2-enyl]-6-methyl-2-oxidanyl-pyran-4-one

Systemtic Name: 3-[(E)-3-(4-chlorophenyl)-1-(4-nitrophenyl)prop-2-enyl]-6-methyl-2-oxidanyl-pyran-4-one Openeye Name: 3-[(E)-3-(4-chlorophenyl)-1-(4-nitrophenyl)allyl]-2-hydroxy-6-methyl-pyran-4-one CAS Name: 3-[(E)-3-(4-chlorophenyl)-1-(4-nitrophenyl)prop-2-enyl]-2-hydroxy-6-methyl-4-pyranone IUPAC Name: 3-[(E)-3-(4-chlorophenyl)-1-(4-nitrophenyl)prop-2-enyl]-2-hydroxy-6-methylpyran-4-one Traditional Name: 3-[(E)-3-(4-chlorophenyl)-1-(4-nitrophenyl)allyl]-2-hydroxy-6-methyl-pyran-4-one Formula: C21H16ClNO5 MolecularWeight: 397.80844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=C(O1)O)C(C=CC2=CC=C(C=C2)Cl)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=O)C(=C(O1)O)C(/C=C/C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H16ClNO5/c1-13-12-19(24)20(21(25)28-13)18(11-4-14-2-7-16(22)8-3-14)15-5-9-17(10-6-15)23(26)27/h2-12,18,25H,1H3/b11-4+