N-[[2-[2-[(2R)-2-methylpyrrolidin-1-yl]ethyl]-1-benzofuran-5-yl]methyl]-3,5-dinitro-pyridin-2-amine

Systemtic Name: N-[[2-[2-[(2R)-2-methylpyrrolidin-1-yl]ethyl]-1-benzofuran-5-yl]methyl]-3,5-dinitro-pyridin-2-amine Openeye Name: N-[[2-[2-[(2R)-2-methylpyrrolidin-1-yl]ethyl]benzofuran-5-yl]methyl]-3,5-dinitro-pyridin-2-amine CAS Name: N-[[2-[2-[(2R)-2-methyl-1-pyrrolidinyl]ethyl]-5-benzofuranyl]methyl]-3,5-dinitro-2-pyridinamine IUPAC Name: N-[[2-[2-[(2R)-2-methylpyrrolidin-1-yl]ethyl]-1-benzofuran-5-yl]methyl]-3,5-dinitropyridin-2-amine Traditional Name: (3,5-dinitro-2-pyridyl)-[[2-[2-[(2R)-2-methylpyrrolidino]ethyl]benzofuran-5-yl]methyl]amine Formula: C21H23N5O5 MolecularWeight: 425.43782

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN1CCC2=CC3=C(O2)C=CC(=C3)CNC4=C(C=C(C=N4)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C[C@@H]1CCCN1CCC2=CC3=C(O2)C=CC(=C3)CNC4=C(C=C(C=N4)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C21H23N5O5/c1-14-3-2-7-24(14)8-6-18-10-16-9-15(4-5-20(16)31-18)12-22-21-19(26(29)30)11-17(13-23-21)25(27)28/h4-5,9-11,13-14H,2-3,6-8,12H2,1H3,(H,22,23)/t14-/m1/s1