N-(4-ethylphenyl)-5-nitro-2-pyrrolidin-1-yl-benzamide

Systemtic Name: N-(4-ethylphenyl)-5-nitro-2-pyrrolidin-1-yl-benzamide Openeye Name: N-(4-ethylphenyl)-5-nitro-2-pyrrolidin-1-yl-benzamide CAS Name: N-(4-ethylphenyl)-5-nitro-2-(1-pyrrolidinyl)benzamide IUPAC Name: N-(4-ethylphenyl)-5-nitro-2-pyrrolidin-1-ylbenzamide Traditional Name: N-(4-ethylphenyl)-5-nitro-2-pyrrolidino-benzamide Formula: C19H21N3O3 MolecularWeight: 339.38834

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCCC3

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCCC3

InChI

InChI=1S/C19H21N3O3/c1-2-14-5-7-15(8-6-14)20-19(23)17-13-16(22(24)25)9-10-18(17)21-11-3-4-12-21/h5-10,13H,2-4,11-12H2,1H3,(H,20,23)