3-(2-bromanyl-4,5-dimethoxy-phenyl)-N-(4-chloranyl-3-nitro-phenyl)propanamide

Systemtic Name: 3-(2-bromanyl-4,5-dimethoxy-phenyl)-N-(4-chloranyl-3-nitro-phenyl)propanamide Openeye Name: 3-(2-bromo-4,5-dimethoxy-phenyl)-N-(4-chloro-3-nitro-phenyl)propanamide CAS Name: 3-(2-bromo-4,5-dimethoxyphenyl)-N-(4-chloro-3-nitrophenyl)propanamide IUPAC Name: 3-(2-bromo-4,5-dimethoxyphenyl)-N-(4-chloro-3-nitrophenyl)propanamide Traditional Name: 3-(2-bromo-4,5-dimethoxy-phenyl)-N-(4-chloro-3-nitro-phenyl)propionamide Formula: C17H16BrClN2O5 MolecularWeight: 443.67634

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CCC(=O)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-])Br)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CCC(=O)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-])Br)OC

InChI

InChI=1S/C17H16BrClN2O5/c1-25-15-7-10(12(18)9-16(15)26-2)3-6-17(22)20-11-4-5-13(19)14(8-11)21(23)24/h4-5,7-9H,3,6H2,1-2H3,(H,20,22)