2-[2-chloranyl-6-methoxy-4-[4-(2-nitrophenyl)piperazin-1-yl]carbonyl-phenoxy]ethanamide

Systemtic Name: 2-[2-chloranyl-6-methoxy-4-[4-(2-nitrophenyl)piperazin-1-yl]carbonyl-phenoxy]ethanamide Openeye Name: 2-[2-chloro-6-methoxy-4-[4-(2-nitrophenyl)piperazine-1-carbonyl]phenoxy]acetamide CAS Name: 2-[2-chloro-6-methoxy-4-[[4-(2-nitrophenyl)-1-piperazinyl]-oxomethyl]phenoxy]acetamide IUPAC Name: 2-[2-chloro-6-methoxy-4-[4-(2-nitrophenyl)piperazine-1-carbonyl]phenoxy]acetamide Traditional Name: 2-[2-chloro-6-methoxy-4-[4-(2-nitrophenyl)piperazine-1-carbonyl]phenoxy]acetamide Formula: C20H21ClN4O6 MolecularWeight: 448.85694

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C(=O)N2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-])Cl)OCC(=O)N

Isomeric SMILES

COC1=C(C(=CC(=C1)C(=O)N2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-])Cl)OCC(=O)N

InChI

InChI=1S/C20H21ClN4O6/c1-30-17-11-13(10-14(21)19(17)31-12-18(22)26)20(27)24-8-6-23(7-9-24)15-4-2-3-5-16(15)25(28)29/h2-5,10-11H,6-9,12H2,1H3,(H2,22,26)