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

Systemtic Name: 4-methoxy-6-methyl-3-[(E)-2-methyl-3-(4-nitrophenyl)-1-oxidanyl-prop-2-enyl]pyran-2-one Openeye Name: 3-[(E)-1-hydroxy-2-methyl-3-(4-nitrophenyl)allyl]-4-methoxy-6-methyl-pyran-2-one CAS Name: 3-[(E)-1-hydroxy-2-methyl-3-(4-nitrophenyl)prop-2-enyl]-4-methoxy-6-methyl-2-pyranone IUPAC Name: 3-[(E)-1-hydroxy-2-methyl-3-(4-nitrophenyl)prop-2-enyl]-4-methoxy-6-methylpyran-2-one Traditional Name: 3-[(E)-1-hydroxy-2-methyl-3-(4-nitrophenyl)allyl]-4-methoxy-6-methyl-pyran-2-one Formula: C17H17NO6 MolecularWeight: 331.31998

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17NO6/c1-10(8-12-4-6-13(7-5-12)18(21)22)16(19)15-14(23-3)9-11(2)24-17(15)20/h4-9,16,19H,1-3H3/b10-8+