N-(2,4-dinitrophenoxy)-1-[4-methoxy-3-(morpholin-4-ium-4-ylmethyl)phenyl]ethanimine

Systemtic Name: N-(2,4-dinitrophenoxy)-1-[4-methoxy-3-(morpholin-4-ium-4-ylmethyl)phenyl]ethanimine Openeye Name: N-(2,4-dinitrophenoxy)-1-[4-methoxy-3-(morpholin-4-ium-4-ylmethyl)phenyl]ethanimine CAS Name: N-(2,4-dinitrophenoxy)-1-[4-methoxy-3-(4-morpholin-4-iumylmethyl)phenyl]ethanimine IUPAC Name: N-(2,4-dinitrophenoxy)-1-[4-methoxy-3-(morpholin-4-ium-4-ylmethyl)phenyl]ethanimine Traditional Name: (Z)-(2,4-dinitrophenoxy)-[1-[4-methoxy-3-(morpholin-4-ium-4-ylmethyl)phenyl]ethylidene]amine Formula: C20H23N4O7+ MolecularWeight: 431.41922

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NOC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])C2=CC(=C(C=C2)OC)C[NH+]3CCOCC3

Isomeric SMILES

C/C(=N/OC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])/C2=CC(=C(C=C2)OC)C[NH+]3CCOCC3

InChI

InChI=1S/C20H22N4O7/c1-14(21-31-20-6-4-17(23(25)26)12-18(20)24(27)28)15-3-5-19(29-2)16(11-15)13-22-7-9-30-10-8-22/h3-6,11-12H,7-10,13H2,1-2H3/p+1/b21-14-