4-methyl-2-[(4-nitrophenyl)methyl]-3-oxidanylidene-cyclopentane-1-carboxylic acid

Systemtic Name: 4-methyl-2-[(4-nitrophenyl)methyl]-3-oxidanylidene-cyclopentane-1-carboxylic acid Openeye Name: 4-methyl-2-[(4-nitrophenyl)methyl]-3-oxo-cyclopentanecarboxylic acid CAS Name: 4-methyl-2-[(4-nitrophenyl)methyl]-3-oxo-1-cyclopentanecarboxylic acid IUPAC Name: 4-methyl-2-[(4-nitrophenyl)methyl]-3-oxocyclopentane-1-carboxylic acid Traditional Name: 3-keto-4-methyl-2-(4-nitrobenzyl)cyclopentanecarboxylic acid Formula: C14H15NO5 MolecularWeight: 277.2726

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C(C1=O)CC2=CC=C(C=C2)[N+](=O)[O-])C(=O)O

Isomeric SMILES

CC1CC(C(C1=O)CC2=CC=C(C=C2)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C14H15NO5/c1-8-6-12(14(17)18)11(13(8)16)7-9-2-4-10(5-3-9)15(19)20/h2-5,8,11-12H,6-7H2,1H3,(H,17,18)