2-[2-[[2-[(2-chloranyl-4-nitro-phenyl)amino]ethylamino]methyl]-6-methoxy-phenoxy]ethanamide

Systemtic Name: 2-[2-[[2-[(2-chloranyl-4-nitro-phenyl)amino]ethylamino]methyl]-6-methoxy-phenoxy]ethanamide Openeye Name: 2-[2-[[2-(2-chloro-4-nitro-anilino)ethylamino]methyl]-6-methoxy-phenoxy]acetamide CAS Name: 2-[2-[[2-(2-chloro-4-nitroanilino)ethylamino]methyl]-6-methoxyphenoxy]acetamide IUPAC Name: 2-[2-[[2-(2-chloro-4-nitroanilino)ethylamino]methyl]-6-methoxyphenoxy]acetamide Traditional Name: 2-[2-[[2-(2-chloro-4-nitro-anilino)ethylamino]methyl]-6-methoxy-phenoxy]acetamide Formula: C18H21ClN4O5 MolecularWeight: 408.83614

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OCC(=O)N)CNCCNC2=C(C=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

COC1=CC=CC(=C1OCC(=O)N)CNCCNC2=C(C=C(C=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C18H21ClN4O5/c1-27-16-4-2-3-12(18(16)28-11-17(20)24)10-21-7-8-22-15-6-5-13(23(25)26)9-14(15)19/h2-6,9,21-22H,7-8,10-11H2,1H3,(H2,20,24)