3-(3-bromophenyl)-N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]propanamide

Systemtic Name: 3-(3-bromophenyl)-N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]propanamide Openeye Name: 3-(3-bromophenyl)-N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]propanamide CAS Name: 3-(3-bromophenyl)-N-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]propanamide IUPAC Name: 3-(3-bromophenyl)-N-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]propanamide Traditional Name: 3-(3-bromophenyl)-N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]propionamide Formula: C19H21BrN2O5 MolecularWeight: 437.28444

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CCNC(=O)CCC2=CC(=CC=C2)Br)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CCNC(=O)CCC2=CC(=CC=C2)Br)[N+](=O)[O-])OC

InChI

InChI=1S/C19H21BrN2O5/c1-26-17-11-14(16(22(24)25)12-18(17)27-2)8-9-21-19(23)7-6-13-4-3-5-15(20)10-13/h3-5,10-12H,6-9H2,1-2H3,(H,21,23)