2,2-dimethyl-3-[4-nitro-2-(phenylmethyl)phenyl]propanal

Systemtic Name: 2,2-dimethyl-3-[4-nitro-2-(phenylmethyl)phenyl]propanal Openeye Name: 3-(2-benzyl-4-nitro-phenyl)-2,2-dimethyl-propanal CAS Name: 2,2-dimethyl-3-[4-nitro-2-(phenylmethyl)phenyl]propanal IUPAC Name: 3-(2-benzyl-4-nitrophenyl)-2,2-dimethylpropanal Traditional Name: 3-(2-benzyl-4-nitro-phenyl)-2,2-dimethyl-propionaldehyde Formula: C18H19NO3 MolecularWeight: 297.34836

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC1=C(C=C(C=C1)[N+](=O)[O-])CC2=CC=CC=C2)C=O

Isomeric SMILES

CC(C)(CC1=C(C=C(C=C1)[N+](=O)[O-])CC2=CC=CC=C2)C=O

InChI

InChI=1S/C18H19NO3/c1-18(2,13-20)12-15-8-9-17(19(21)22)11-16(15)10-14-6-4-3-5-7-14/h3-9,11,13H,10,12H2,1-2H3