N-[2-(2-bromanyl-4,5-dimethoxy-phenyl)ethyl]-4-(2-methoxyethylamino)-3-nitro-benzamide

Systemtic Name: N-[2-(2-bromanyl-4,5-dimethoxy-phenyl)ethyl]-4-(2-methoxyethylamino)-3-nitro-benzamide Openeye Name: N-[2-(2-bromo-4,5-dimethoxy-phenyl)ethyl]-4-(2-methoxyethylamino)-3-nitro-benzamide CAS Name: N-[2-(2-bromo-4,5-dimethoxyphenyl)ethyl]-4-(2-methoxyethylamino)-3-nitrobenzamide IUPAC Name: N-[2-(2-bromo-4,5-dimethoxyphenyl)ethyl]-4-(2-methoxyethylamino)-3-nitrobenzamide Traditional Name: N-[2-(2-bromo-4,5-dimethoxy-phenyl)ethyl]-4-(2-methoxyethylamino)-3-nitro-benzamide Formula: C20H24BrN3O6 MolecularWeight: 482.32506

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC1=C(C=C(C=C1)C(=O)NCCC2=CC(=C(C=C2Br)OC)OC)[N+](=O)[O-]

Isomeric SMILES

COCCNC1=C(C=C(C=C1)C(=O)NCCC2=CC(=C(C=C2Br)OC)OC)[N+](=O)[O-]

InChI

InChI=1S/C20H24BrN3O6/c1-28-9-8-22-16-5-4-14(10-17(16)24(26)27)20(25)23-7-6-13-11-18(29-2)19(30-3)12-15(13)21/h4-5,10-12,22H,6-9H2,1-3H3,(H,23,25)