1-[1-(2,6-dinitro-4-propan-2-yl-phenyl)propylamino]propan-2-ol

Systemtic Name: 1-[1-(2,6-dinitro-4-propan-2-yl-phenyl)propylamino]propan-2-ol Openeye Name: 1-[1-(4-isopropyl-2,6-dinitro-phenyl)propylamino]propan-2-ol CAS Name: 1-[1-(2,6-dinitro-4-propan-2-ylphenyl)propylamino]-2-propanol IUPAC Name: 1-[1-(2,6-dinitro-4-propan-2-ylphenyl)propylamino]propan-2-ol Traditional Name: 1-[1-(4-isopropyl-2,6-dinitro-phenyl)propylamino]propan-2-ol Formula: C15H23N3O5 MolecularWeight: 325.36022

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=C(C=C(C=C1[N+](=O)[O-])C(C)C)[N+](=O)[O-])NCC(C)O

Isomeric SMILES

CCC(C1=C(C=C(C=C1[N+](=O)[O-])C(C)C)[N+](=O)[O-])NCC(C)O

InChI

InChI=1S/C15H23N3O5/c1-5-12(16-8-10(4)19)15-13(17(20)21)6-11(9(2)3)7-14(15)18(22)23/h6-7,9-10,12,16,19H,5,8H2,1-4H3