3-bromanyl-N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-1-methyl-indole-2-carboxamide

Systemtic Name: 3-bromanyl-N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-1-methyl-indole-2-carboxamide Openeye Name: 3-bromo-N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-1-methyl-indole-2-carboxamide CAS Name: 3-bromo-N-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]-1-methyl-2-indolecarboxamide IUPAC Name: 3-bromo-N-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]-1-methylindole-2-carboxamide Traditional Name: 3-bromo-N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-1-methyl-indole-2-carboxamide Formula: C20H20BrN3O5 MolecularWeight: 462.2939

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=C1C(=O)NCCC3=CC(=C(C=C3[N+](=O)[O-])OC)OC)Br

Isomeric SMILES

CN1C2=CC=CC=C2C(=C1C(=O)NCCC3=CC(=C(C=C3[N+](=O)[O-])OC)OC)Br

InChI

InChI=1S/C20H20BrN3O5/c1-23-14-7-5-4-6-13(14)18(21)19(23)20(25)22-9-8-12-10-16(28-2)17(29-3)11-15(12)24(26)27/h4-7,10-11H,8-9H2,1-3H3,(H,22,25)