4-[(2S)-2-ethylpiperidin-1-yl]-3-nitro-benzamide

Systemtic Name: 4-[(2S)-2-ethylpiperidin-1-yl]-3-nitro-benzamide Openeye Name: 4-[(2S)-2-ethyl-1-piperidyl]-3-nitro-benzamide CAS Name: 4-[(2S)-2-ethyl-1-piperidinyl]-3-nitrobenzamide IUPAC Name: 4-[(2S)-2-ethylpiperidin-1-yl]-3-nitrobenzamide Traditional Name: 4-[(2S)-2-ethylpiperidino]-3-nitro-benzamide Formula: C14H19N3O3 MolecularWeight: 277.31896

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1C2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C14H19N3O3/c1-2-11-5-3-4-8-16(11)12-7-6-10(14(15)18)9-13(12)17(19)20/h6-7,9,11H,2-5,8H2,1H3,(H2,15,18)/t11-/m0/s1