N-[[(2R)-1-ethylpyrrolidin-2-yl]methyl]-3-nitro-4-piperidin-1-yl-benzamide

Systemtic Name: N-[[(2R)-1-ethylpyrrolidin-2-yl]methyl]-3-nitro-4-piperidin-1-yl-benzamide Openeye Name: N-[[(2R)-1-ethylpyrrolidin-2-yl]methyl]-3-nitro-4-(1-piperidyl)benzamide CAS Name: N-[[(2R)-1-ethyl-2-pyrrolidinyl]methyl]-3-nitro-4-(1-piperidinyl)benzamide IUPAC Name: N-[[(2R)-1-ethylpyrrolidin-2-yl]methyl]-3-nitro-4-piperidin-1-ylbenzamide Traditional Name: N-[[(2R)-1-ethylpyrrolidin-2-yl]methyl]-3-nitro-4-piperidino-benzamide Formula: C19H28N4O3 MolecularWeight: 360.45062

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCCC1CNC(=O)C2=CC(=C(C=C2)N3CCCCC3)[N+](=O)[O-]

Isomeric SMILES

CCN1CCC[C@@H]1CNC(=O)C2=CC(=C(C=C2)N3CCCCC3)[N+](=O)[O-]

InChI

InChI=1S/C19H28N4O3/c1-2-21-12-6-7-16(21)14-20-19(24)15-8-9-17(18(13-15)23(25)26)22-10-4-3-5-11-22/h8-9,13,16H,2-7,10-12,14H2,1H3,(H,20,24)/t16-/m1/s1