(5-methoxy-5-nitro-cyclohexa-1,3-dien-1-yl)-phenyl-methanone

Systemtic Name: (5-methoxy-5-nitro-cyclohexa-1,3-dien-1-yl)-phenyl-methanone Openeye Name: (5-methoxy-5-nitro-cyclohexa-1,3-dien-1-yl)-phenyl-methanone CAS Name: (5-methoxy-5-nitro-1-cyclohexa-1,3-dienyl)-phenylmethanone IUPAC Name: (5-methoxy-5-nitrocyclohexa-1,3-dien-1-yl)-phenylmethanone Traditional Name: (5-methoxy-5-nitro-cyclohexa-1,3-dien-1-yl)-phenyl-methanone Formula: C14H13NO4 MolecularWeight: 259.25732

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Descriptors Computed from Structure

Canonical SMILES:

COC1(CC(=CC=C1)C(=O)C2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

COC1(CC(=CC=C1)C(=O)C2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H13NO4/c1-19-14(15(17)18)9-5-8-12(10-14)13(16)11-6-3-2-4-7-11/h2-9H,10H2,1H3