methyl 2-methyl-2-[(2-nitrophenyl)methyl]-3-oxidanylidene-5-phenyl-pentanoate

Systemtic Name: methyl 2-methyl-2-[(2-nitrophenyl)methyl]-3-oxidanylidene-5-phenyl-pentanoate Openeye Name: methyl 2-methyl-2-[(2-nitrophenyl)methyl]-3-oxo-5-phenyl-pentanoate CAS Name: 2-methyl-2-[(2-nitrophenyl)methyl]-3-oxo-5-phenylpentanoic acid methyl ester IUPAC Name: methyl 2-methyl-2-[(2-nitrophenyl)methyl]-3-oxo-5-phenylpentanoate Traditional Name: 3-keto-2-methyl-2-(2-nitrobenzyl)-5-phenyl-valeric acid methyl ester Formula: C20H21NO5 MolecularWeight: 355.38444

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=CC=C1[N+](=O)[O-])(C(=O)CCC2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CC(CC1=CC=CC=C1[N+](=O)[O-])(C(=O)CCC2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C20H21NO5/c1-20(19(23)26-2,14-16-10-6-7-11-17(16)21(24)25)18(22)13-12-15-8-4-3-5-9-15/h3-11H,12-14H2,1-2H3