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

Systemtic Name: 6-methyl-3-[(E)-3-(3-nitro-4-phenylmethoxy-phenyl)prop-2-enoyl]-2-oxidanyl-pyran-4-one Openeye Name: 3-[(E)-3-(4-benzyloxy-3-nitro-phenyl)prop-2-enoyl]-2-hydroxy-6-methyl-pyran-4-one CAS Name: 2-hydroxy-6-methyl-3-[(E)-3-(3-nitro-4-phenylmethoxyphenyl)-1-oxoprop-2-enyl]-4-pyranone IUPAC Name: 2-hydroxy-6-methyl-3-[(E)-3-(3-nitro-4-phenylmethoxyphenyl)prop-2-enoyl]pyran-4-one Traditional Name: 3-[(E)-3-(4-benzoxy-3-nitro-phenyl)acryloyl]-2-hydroxy-6-methyl-pyran-4-one Formula: C22H17NO7 MolecularWeight: 407.37288

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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)OCC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=O)C(=C(O1)O)C(=O)/C=C/C2=CC(=C(C=C2)OCC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H17NO7/c1-14-11-19(25)21(22(26)30-14)18(24)9-7-15-8-10-20(17(12-15)23(27)28)29-13-16-5-3-2-4-6-16/h2-12,26H,13H2,1H3/b9-7+