2-(dimethylamino)-N-[3-[(2S)-2-methylpiperidin-1-yl]propyl]-5-nitro-benzamide

Systemtic Name: 2-(dimethylamino)-N-[3-[(2S)-2-methylpiperidin-1-yl]propyl]-5-nitro-benzamide Openeye Name: 2-(dimethylamino)-N-[3-[(2S)-2-methyl-1-piperidyl]propyl]-5-nitro-benzamide CAS Name: 2-(dimethylamino)-N-[3-[(2S)-2-methyl-1-piperidinyl]propyl]-5-nitrobenzamide IUPAC Name: 2-(dimethylamino)-N-[3-[(2S)-2-methylpiperidin-1-yl]propyl]-5-nitrobenzamide Traditional Name: 2-(dimethylamino)-N-[3-[(2S)-2-methylpiperidino]propyl]-5-nitro-benzamide Formula: C18H28N4O3 MolecularWeight: 348.43992

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1CCCNC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N(C)C

Isomeric SMILES

C[C@H]1CCCCN1CCCNC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N(C)C

InChI

InChI=1S/C18H28N4O3/c1-14-7-4-5-11-21(14)12-6-10-19-18(23)16-13-15(22(24)25)8-9-17(16)20(2)3/h8-9,13-14H,4-7,10-12H2,1-3H3,(H,19,23)/t14-/m0/s1