(Z)-4-[3-nitro-4,5-bis(oxidanyl)phenyl]-3-phenyl-but-3-en-2-one

Systemtic Name: (Z)-4-[3-nitro-4,5-bis(oxidanyl)phenyl]-3-phenyl-but-3-en-2-one Openeye Name: (Z)-4-(3,4-dihydroxy-5-nitro-phenyl)-3-phenyl-but-3-en-2-one CAS Name: (Z)-4-(3,4-dihydroxy-5-nitrophenyl)-3-phenyl-3-buten-2-one IUPAC Name: (Z)-4-(3,4-dihydroxy-5-nitrophenyl)-3-phenylbut-3-en-2-one Traditional Name: (Z)-4-(3,4-dihydroxy-5-nitro-phenyl)-3-phenyl-but-3-en-2-one Formula: C16H13NO5 MolecularWeight: 299.27812

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=CC1=CC(=C(C(=C1)O)O)[N+](=O)[O-])C2=CC=CC=C2

Isomeric SMILES

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

InChI

InChI=1S/C16H13NO5/c1-10(18)13(12-5-3-2-4-6-12)7-11-8-14(17(21)22)16(20)15(19)9-11/h2-9,19-20H,1H3/b13-7+