4-(3-nitrophenyl)-3-[(3-nitrophenyl)methyl]butan-2-one

Systemtic Name: 4-(3-nitrophenyl)-3-[(3-nitrophenyl)methyl]butan-2-one Openeye Name: 4-(3-nitrophenyl)-3-[(3-nitrophenyl)methyl]butan-2-one CAS Name: 4-(3-nitrophenyl)-3-[(3-nitrophenyl)methyl]-2-butanone IUPAC Name: 4-(3-nitrophenyl)-3-[(3-nitrophenyl)methyl]butan-2-one Traditional Name: 3-(3-nitrobenzyl)-4-(3-nitrophenyl)butan-2-one Formula: C17H16N2O5 MolecularWeight: 328.31934

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(CC1=CC(=CC=C1)[N+](=O)[O-])CC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C(CC1=CC(=CC=C1)[N+](=O)[O-])CC2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H16N2O5/c1-12(20)15(8-13-4-2-6-16(10-13)18(21)22)9-14-5-3-7-17(11-14)19(23)24/h2-7,10-11,15H,8-9H2,1H3