1-[2-[2,4-dinitro-5-(piperidin-1-ylamino)phenoxy]-4-methoxy-phenyl]ethanone

Systemtic Name: 1-[2-[2,4-dinitro-5-(piperidin-1-ylamino)phenoxy]-4-methoxy-phenyl]ethanone Openeye Name: 1-[2-[2,4-dinitro-5-(1-piperidylamino)phenoxy]-4-methoxy-phenyl]ethanone CAS Name: 1-[2-[2,4-dinitro-5-(1-piperidinylamino)phenoxy]-4-methoxyphenyl]ethanone IUPAC Name: 1-[2-[2,4-dinitro-5-(piperidin-1-ylamino)phenoxy]-4-methoxyphenyl]ethanone Traditional Name: 1-[2-[2,4-dinitro-5-(piperidinoamino)phenoxy]-4-methoxy-phenyl]ethanone Formula: C20H22N4O7 MolecularWeight: 430.41128

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C=C(C=C1)OC)OC2=C(C=C(C(=C2)NN3CCCCC3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1=C(C=C(C=C1)OC)OC2=C(C=C(C(=C2)NN3CCCCC3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C20H22N4O7/c1-13(25)15-7-6-14(30-2)10-19(15)31-20-11-16(21-22-8-4-3-5-9-22)17(23(26)27)12-18(20)24(28)29/h6-7,10-12,21H,3-5,8-9H2,1-2H3