1-nitro-2-(phenylmethyl)-3-propan-2-yl-benzene

Systemtic Name: 1-nitro-2-(phenylmethyl)-3-propan-2-yl-benzene Openeye Name: 2-benzyl-1-isopropyl-3-nitro-benzene CAS Name: 1-nitro-2-(phenylmethyl)-3-propan-2-ylbenzene IUPAC Name: 2-benzyl-1-nitro-3-propan-2-ylbenzene Traditional Name: 2-benzyl-1-isopropyl-3-nitro-benzene Formula: C16H17NO2 MolecularWeight: 255.31168

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17NO2/c1-12(2)14-9-6-10-16(17(18)19)15(14)11-13-7-4-3-5-8-13/h3-10,12H,11H2,1-2H3