3,5-dimethyl-2-(4-nitrophenyl)-6-phenyl-oxan-4-one

Systemtic Name: 3,5-dimethyl-2-(4-nitrophenyl)-6-phenyl-oxan-4-one Openeye Name: 3,5-dimethyl-2-(4-nitrophenyl)-6-phenyl-tetrahydropyran-4-one CAS Name: 3,5-dimethyl-2-(4-nitrophenyl)-6-phenyl-4-oxanone IUPAC Name: 3,5-dimethyl-2-(4-nitrophenyl)-6-phenyloxan-4-one Traditional Name: 3,5-dimethyl-2-(4-nitrophenyl)-6-phenyl-tetrahydropyran-4-one Formula: C19H19NO4 MolecularWeight: 325.35846

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(OC(C(C1=O)C)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3

Isomeric SMILES

CC1C(OC(C(C1=O)C)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C19H19NO4/c1-12-17(21)13(2)19(15-8-10-16(11-9-15)20(22)23)24-18(12)14-6-4-3-5-7-14/h3-13,18-19H,1-2H3