N-tert-butyl-4-[(3S)-3-methylpiperidin-1-yl]-3-nitro-benzamide

Systemtic Name: N-tert-butyl-4-[(3S)-3-methylpiperidin-1-yl]-3-nitro-benzamide Openeye Name: N-tert-butyl-4-[(3S)-3-methyl-1-piperidyl]-3-nitro-benzamide CAS Name: N-tert-butyl-4-[(3S)-3-methyl-1-piperidinyl]-3-nitrobenzamide IUPAC Name: N-tert-butyl-4-[(3S)-3-methylpiperidin-1-yl]-3-nitrobenzamide Traditional Name: N-tert-butyl-4-[(3S)-3-methylpiperidino]-3-nitro-benzamide Formula: C17H25N3O3 MolecularWeight: 319.3987

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C2=C(C=C(C=C2)C(=O)NC(C)(C)C)[N+](=O)[O-]

Isomeric SMILES

C[C@H]1CCCN(C1)C2=C(C=C(C=C2)C(=O)NC(C)(C)C)[N+](=O)[O-]

InChI

InChI=1S/C17H25N3O3/c1-12-6-5-9-19(11-12)14-8-7-13(10-15(14)20(22)23)16(21)18-17(2,3)4/h7-8,10,12H,5-6,9,11H2,1-4H3,(H,18,21)/t12-/m0/s1