methyl 4,4-dimethyl-2-[(2-nitrophenyl)methyl]-3-oxidanylidene-pentanoate

Systemtic Name: methyl 4,4-dimethyl-2-[(2-nitrophenyl)methyl]-3-oxidanylidene-pentanoate Openeye Name: methyl 4,4-dimethyl-2-[(2-nitrophenyl)methyl]-3-oxo-pentanoate CAS Name: 4,4-dimethyl-2-[(2-nitrophenyl)methyl]-3-oxopentanoic acid methyl ester IUPAC Name: methyl 4,4-dimethyl-2-[(2-nitrophenyl)methyl]-3-oxopentanoate Traditional Name: 3-keto-4,4-dimethyl-2-(2-nitrobenzyl)valeric acid methyl ester Formula: C15H19NO5 MolecularWeight: 293.31506

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19NO5/c1-15(2,3)13(17)11(14(18)21-4)9-10-7-5-6-8-12(10)16(19)20/h5-8,11H,9H2,1-4H3