1-cyclohexylidene-4-(4-nitrophenyl)-4-oxidanyl-butan-2-one

Systemtic Name: 1-cyclohexylidene-4-(4-nitrophenyl)-4-oxidanyl-butan-2-one Openeye Name: 1-cyclohexylidene-4-hydroxy-4-(4-nitrophenyl)butan-2-one CAS Name: 1-cyclohexylidene-4-hydroxy-4-(4-nitrophenyl)-2-butanone IUPAC Name: 1-cyclohexylidene-4-hydroxy-4-(4-nitrophenyl)butan-2-one Traditional Name: 1-cyclohexylidene-4-hydroxy-4-(4-nitrophenyl)butan-2-one Formula: C16H19NO4 MolecularWeight: 289.32636

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=CC(=O)CC(C2=CC=C(C=C2)[N+](=O)[O-])O)CC1

Isomeric SMILES

C1CCC(=CC(=O)CC(C2=CC=C(C=C2)[N+](=O)[O-])O)CC1

InChI

InChI=1S/C16H19NO4/c18-15(10-12-4-2-1-3-5-12)11-16(19)13-6-8-14(9-7-13)17(20)21/h6-10,16,19H,1-5,11H2