2-chloranyl-N-[3-(4-dimethylaminophenyl)propyl]-5-nitro-benzamide

Systemtic Name: 2-chloranyl-N-[3-(4-dimethylaminophenyl)propyl]-5-nitro-benzamide Openeye Name: 2-chloro-N-[3-(4-dimethylaminophenyl)propyl]-5-nitro-benzamide CAS Name: 2-chloro-N-[3-(4-dimethylaminophenyl)propyl]-5-nitrobenzamide IUPAC Name: 2-chloro-N-[3-(4-dimethylaminophenyl)propyl]-5-nitrobenzamide Traditional Name: 2-chloro-N-[3-(4-dimethylaminophenyl)propyl]-5-nitro-benzamide Formula: C18H20ClN3O3 MolecularWeight: 361.8227

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20ClN3O3/c1-21(2)14-7-5-13(6-8-14)4-3-11-20-18(23)16-12-15(22(24)25)9-10-17(16)19/h5-10,12H,3-4,11H2,1-2H3,(H,20,23)