2-chloranyl-N-[3-[methyl-(phenylmethyl)amino]propyl]-4-nitro-benzamide

Systemtic Name: 2-chloranyl-N-[3-[methyl-(phenylmethyl)amino]propyl]-4-nitro-benzamide Openeye Name: N-[3-[benzyl(methyl)amino]propyl]-2-chloro-4-nitro-benzamide CAS Name: 2-chloro-N-[3-[methyl-(phenylmethyl)amino]propyl]-4-nitrobenzamide IUPAC Name: N-[3-[benzyl(methyl)amino]propyl]-2-chloro-4-nitrobenzamide Traditional Name: N-[3-[benzyl(methyl)amino]propyl]-2-chloro-4-nitro-benzamide Formula: C18H20ClN3O3 MolecularWeight: 361.8227

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCNC(=O)C1=C(C=C(C=C1)[N+](=O)[O-])Cl)CC2=CC=CC=C2

Isomeric SMILES

CN(CCCNC(=O)C1=C(C=C(C=C1)[N+](=O)[O-])Cl)CC2=CC=CC=C2

InChI

InChI=1S/C18H20ClN3O3/c1-21(13-14-6-3-2-4-7-14)11-5-10-20-18(23)16-9-8-15(22(24)25)12-17(16)19/h2-4,6-9,12H,5,10-11,13H2,1H3,(H,20,23)