6-methyl-3-[5-(4-nitrophenyl)pentanoyl]pyran-2,4-dione

Systemtic Name: 6-methyl-3-[5-(4-nitrophenyl)pentanoyl]pyran-2,4-dione Openeye Name: 6-methyl-3-[5-(4-nitrophenyl)pentanoyl]pyran-2,4-dione CAS Name: 6-methyl-3-[5-(4-nitrophenyl)-1-oxopentyl]pyran-2,4-dione IUPAC Name: 6-methyl-3-[5-(4-nitrophenyl)pentanoyl]pyran-2,4-dione Traditional Name: 6-methyl-3-[5-(4-nitrophenyl)pentanoyl]pyran-2,4-quinone Formula: C17H17NO6 MolecularWeight: 331.31998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(C(=O)O1)C(=O)CCCCC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=O)C(C(=O)O1)C(=O)CCCCC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H17NO6/c1-11-10-15(20)16(17(21)24-11)14(19)5-3-2-4-12-6-8-13(9-7-12)18(22)23/h6-10,16H,2-5H2,1H3