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

Systemtic Name: N-ethoxy-4-[(3S)-3-methylpiperidin-1-yl]-3-nitro-benzamide Openeye Name: N-ethoxy-4-[(3S)-3-methyl-1-piperidyl]-3-nitro-benzamide CAS Name: N-ethoxy-4-[(3S)-3-methyl-1-piperidinyl]-3-nitrobenzamide IUPAC Name: N-ethoxy-4-[(3S)-3-methylpiperidin-1-yl]-3-nitrobenzamide Traditional Name: N-ethoxy-4-[(3S)-3-methylpiperidino]-3-nitro-benzamide Formula: C15H21N3O4 MolecularWeight: 307.34494

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Descriptors Computed from Structure

Canonical SMILES:

CCONC(=O)C1=CC(=C(C=C1)N2CCCC(C2)C)[N+](=O)[O-]

Isomeric SMILES

CCONC(=O)C1=CC(=C(C=C1)N2CCC[C@@H](C2)C)[N+](=O)[O-]

InChI

InChI=1S/C15H21N3O4/c1-3-22-16-15(19)12-6-7-13(14(9-12)18(20)21)17-8-4-5-11(2)10-17/h6-7,9,11H,3-5,8,10H2,1-2H3,(H,16,19)/t11-/m0/s1