3-(4-methoxyphenyl)-4-nitro-1-phenyl-butan-1-one

Systemtic Name: 3-(4-methoxyphenyl)-4-nitro-1-phenyl-butan-1-one Openeye Name: 3-(4-methoxyphenyl)-4-nitro-1-phenyl-butan-1-one CAS Name: 3-(4-methoxyphenyl)-4-nitro-1-phenyl-1-butanone IUPAC Name: 3-(4-methoxyphenyl)-4-nitro-1-phenylbutan-1-one Traditional Name: 3-(4-methoxyphenyl)-4-nitro-1-phenyl-butan-1-one Formula: C17H17NO4 MolecularWeight: 299.32118

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17NO4/c1-22-16-9-7-13(8-10-16)15(12-18(20)21)11-17(19)14-5-3-2-4-6-14/h2-10,15H,11-12H2,1H3