1-(3-methoxy-5-nitro-4-oxidanyl-phenyl)-4-phenyl-butan-1-one

Systemtic Name: 1-(3-methoxy-5-nitro-4-oxidanyl-phenyl)-4-phenyl-butan-1-one Openeye Name: 1-(4-hydroxy-3-methoxy-5-nitro-phenyl)-4-phenyl-butan-1-one CAS Name: 1-(4-hydroxy-3-methoxy-5-nitrophenyl)-4-phenyl-1-butanone IUPAC Name: 1-(4-hydroxy-3-methoxy-5-nitrophenyl)-4-phenylbutan-1-one Traditional Name: 1-(4-hydroxy-3-methoxy-5-nitro-phenyl)-4-phenyl-butan-1-one Formula: C17H17NO5 MolecularWeight: 315.32058

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1O)[N+](=O)[O-])C(=O)CCCC2=CC=CC=C2

Isomeric SMILES

COC1=CC(=CC(=C1O)[N+](=O)[O-])C(=O)CCCC2=CC=CC=C2

InChI

InChI=1S/C17H17NO5/c1-23-16-11-13(10-14(17(16)20)18(21)22)15(19)9-5-8-12-6-3-2-4-7-12/h2-4,6-7,10-11,20H,5,8-9H2,1H3