N-[4-[(2S)-2-methylpiperidin-1-yl]phenyl]-2-nitro-benzamide

Systemtic Name: N-[4-[(2S)-2-methylpiperidin-1-yl]phenyl]-2-nitro-benzamide Openeye Name: N-[4-[(2S)-2-methyl-1-piperidyl]phenyl]-2-nitro-benzamide CAS Name: N-[4-[(2S)-2-methyl-1-piperidinyl]phenyl]-2-nitrobenzamide IUPAC Name: N-[4-[(2S)-2-methylpiperidin-1-yl]phenyl]-2-nitrobenzamide Traditional Name: N-[4-[(2S)-2-methylpiperidino]phenyl]-2-nitro-benzamide Formula: C19H21N3O3 MolecularWeight: 339.38834

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C[C@H]1CCCCN1C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C19H21N3O3/c1-14-6-4-5-13-21(14)16-11-9-15(10-12-16)20-19(23)17-7-2-3-8-18(17)22(24)25/h2-3,7-12,14H,4-6,13H2,1H3,(H,20,23)/t14-/m0/s1