3-[(E)-3-(3-nitrophenyl)prop-2-enoyl]-2-oxidanyl-cyclohepta-2,4,6-trien-1-one

Systemtic Name: 3-[(E)-3-(3-nitrophenyl)prop-2-enoyl]-2-oxidanyl-cyclohepta-2,4,6-trien-1-one Openeye Name: 2-hydroxy-3-[(E)-3-(3-nitrophenyl)prop-2-enoyl]cyclohepta-2,4,6-trien-1-one CAS Name: 2-hydroxy-3-[(E)-3-(3-nitrophenyl)-1-oxoprop-2-enyl]-1-cyclohepta-2,4,6-trienone IUPAC Name: 2-hydroxy-3-[(E)-3-(3-nitrophenyl)prop-2-enoyl]cyclohepta-2,4,6-trien-1-one Traditional Name: 2-hydroxy-3-[(E)-3-(3-nitrophenyl)acryloyl]cyclohepta-2,4,6-trien-1-one Formula: C16H11NO5 MolecularWeight: 297.26224

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=O)C=C1)O)C(=O)C=CC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C(=O)C=C1)O)C(=O)/C=C/C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H11NO5/c18-14(13-6-1-2-7-15(19)16(13)20)9-8-11-4-3-5-12(10-11)17(21)22/h1-10H,(H,19,20)/b9-8+