4-[2-(4-bromanylphenoxy)ethyl-methyl-amino]-3-nitro-benzamide

Systemtic Name: 4-[2-(4-bromanylphenoxy)ethyl-methyl-amino]-3-nitro-benzamide Openeye Name: 4-[2-(4-bromophenoxy)ethyl-methyl-amino]-3-nitro-benzamide CAS Name: 4-[2-(4-bromophenoxy)ethyl-methylamino]-3-nitrobenzamide IUPAC Name: 4-[2-(4-bromophenoxy)ethyl-methylamino]-3-nitrobenzamide Traditional Name: 4-[2-(4-bromophenoxy)ethyl-methyl-amino]-3-nitro-benzamide Formula: C16H16BrN3O4 MolecularWeight: 394.21994

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCOC1=CC=C(C=C1)Br)C2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

CN(CCOC1=CC=C(C=C1)Br)C2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C16H16BrN3O4/c1-19(8-9-24-13-5-3-12(17)4-6-13)14-7-2-11(16(18)21)10-15(14)20(22)23/h2-7,10H,8-9H2,1H3,(H2,18,21)