3-[(E)-3-(4-bromanyl-3-nitro-phenyl)prop-2-enoyl]-6-methyl-2-oxidanyl-pyran-4-one

Systemtic Name: 3-[(E)-3-(4-bromanyl-3-nitro-phenyl)prop-2-enoyl]-6-methyl-2-oxidanyl-pyran-4-one Openeye Name: 3-[(E)-3-(4-bromo-3-nitro-phenyl)prop-2-enoyl]-2-hydroxy-6-methyl-pyran-4-one CAS Name: 3-[(E)-3-(4-bromo-3-nitrophenyl)-1-oxoprop-2-enyl]-2-hydroxy-6-methyl-4-pyranone IUPAC Name: 3-[(E)-3-(4-bromo-3-nitrophenyl)prop-2-enoyl]-2-hydroxy-6-methylpyran-4-one Traditional Name: 3-[(E)-3-(4-bromo-3-nitro-phenyl)acryloyl]-2-hydroxy-6-methyl-pyran-4-one Formula: C15H10BrNO6 MolecularWeight: 380.147

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H10BrNO6/c1-8-6-13(19)14(15(20)23-8)12(18)5-3-9-2-4-10(16)11(7-9)17(21)22/h2-7,20H,1H3/b5-3+