1-nitropropane; phenylmethoxymethylbenzene; 1,2,3-tris(chloranyl)propane

Systemtic Name: 1-nitropropane; phenylmethoxymethylbenzene; 1,2,3-tris(chloranyl)propane Openeye Name: benzyloxymethylbenzene; 1-nitropropane; 1,2,3-trichloropropane CAS Name: 1-nitropropane; phenylmethoxymethylbenzene; 1,2,3-trichloropropane IUPAC Name: 1-nitropropane; phenylmethoxymethylbenzene; 1,2,3-trichloropropane Traditional Name: benzoxymethylbenzene; 1-nitropropane; 1,2,3-trichloropropane Formula: C20H26Cl3NO3 MolecularWeight: 434.78434

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Descriptors Computed from Structure

Canonical SMILES:

CCC[N+](=O)[O-].C1=CC=C(C=C1)COCC2=CC=CC=C2.C(C(CCl)Cl)Cl

Isomeric SMILES

CCC[N+](=O)[O-].C1=CC=C(C=C1)COCC2=CC=CC=C2.C(C(CCl)Cl)Cl

InChI

InChI=1S/C14H14O.C3H5Cl3.C3H7NO2/c1-3-7-13(8-4-1)11-15-12-14-9-5-2-6-10-14;4-1-3(6)2-5;1-2-3-4(5)6/h1-10H,11-12H2;3H,1-2H2;2-3H2,1H3