2-chloranyl-N-(2-naphthalen-1-yl-2-pyrrolidin-1-yl-ethyl)-4-nitro-benzamide

Systemtic Name: 2-chloranyl-N-(2-naphthalen-1-yl-2-pyrrolidin-1-yl-ethyl)-4-nitro-benzamide Openeye Name: 2-chloro-N-[2-(1-naphthyl)-2-pyrrolidin-1-yl-ethyl]-4-nitro-benzamide CAS Name: 2-chloro-N-[2-(1-naphthalenyl)-2-(1-pyrrolidinyl)ethyl]-4-nitrobenzamide IUPAC Name: 2-chloro-N-(2-naphthalen-1-yl-2-pyrrolidin-1-ylethyl)-4-nitrobenzamide Traditional Name: 2-chloro-N-[2-(1-naphthyl)-2-pyrrolidino-ethyl]-4-nitro-benzamide Formula: C23H22ClN3O3 MolecularWeight: 423.89208

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(CNC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

C1CCN(C1)C(CNC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C23H22ClN3O3/c24-21-14-17(27(29)30)10-11-20(21)23(28)25-15-22(26-12-3-4-13-26)19-9-5-7-16-6-1-2-8-18(16)19/h1-2,5-11,14,22H,3-4,12-13,15H2,(H,25,28)