2-[2,4-bis(bromanyl)-6-methyl-phenoxy]-N-(3-nitro-4-piperazin-1-yl-phenyl)ethanamide

Systemtic Name: 2-[2,4-bis(bromanyl)-6-methyl-phenoxy]-N-(3-nitro-4-piperazin-1-yl-phenyl)ethanamide Openeye Name: 2-(2,4-dibromo-6-methyl-phenoxy)-N-(3-nitro-4-piperazin-1-yl-phenyl)acetamide CAS Name: 2-(2,4-dibromo-6-methylphenoxy)-N-[3-nitro-4-(1-piperazinyl)phenyl]acetamide IUPAC Name: 2-(2,4-dibromo-6-methylphenoxy)-N-(3-nitro-4-piperazin-1-ylphenyl)acetamide Traditional Name: 2-(2,4-dibromo-6-methyl-phenoxy)-N-(3-nitro-4-piperazino-phenyl)acetamide Formula: C19H20Br2N4O4 MolecularWeight: 528.1945

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCC(=O)NC2=CC(=C(C=C2)N3CCNCC3)[N+](=O)[O-])Br)Br

Isomeric SMILES

CC1=CC(=CC(=C1OCC(=O)NC2=CC(=C(C=C2)N3CCNCC3)[N+](=O)[O-])Br)Br

InChI

InChI=1S/C19H20Br2N4O4/c1-12-8-13(20)9-15(21)19(12)29-11-18(26)23-14-2-3-16(17(10-14)25(27)28)24-6-4-22-5-7-24/h2-3,8-10,22H,4-7,11H2,1H3,(H,23,26)