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

Systemtic Name: N-[3-[(2S)-2-methylpiperidin-1-yl]propyl]-3-nitro-benzamide Openeye Name: N-[3-[(2S)-2-methyl-1-piperidyl]propyl]-3-nitro-benzamide CAS Name: N-[3-[(2S)-2-methyl-1-piperidinyl]propyl]-3-nitrobenzamide IUPAC Name: N-[3-[(2S)-2-methylpiperidin-1-yl]propyl]-3-nitrobenzamide Traditional Name: N-[3-[(2S)-2-methylpiperidino]propyl]-3-nitro-benzamide Formula: C16H23N3O3 MolecularWeight: 305.37212

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23N3O3/c1-13-6-2-3-10-18(13)11-5-9-17-16(20)14-7-4-8-15(12-14)19(21)22/h4,7-8,12-13H,2-3,5-6,9-11H2,1H3,(H,17,20)/t13-/m0/s1