2-(3-methylphenoxy)-N-[(E)-(4-morpholin-4-yl-3-nitro-phenyl)methylideneamino]ethanamide

Systemtic Name: 2-(3-methylphenoxy)-N-[(E)-(4-morpholin-4-yl-3-nitro-phenyl)methylideneamino]ethanamide Openeye Name: 2-(3-methylphenoxy)-N-[(E)-(4-morpholino-3-nitro-phenyl)methyleneamino]acetamide CAS Name: 2-(3-methylphenoxy)-N-[(E)-[4-(4-morpholinyl)-3-nitrophenyl]methylideneamino]acetamide IUPAC Name: 2-(3-methylphenoxy)-N-[(E)-(4-morpholin-4-yl-3-nitrophenyl)methylideneamino]acetamide Traditional Name: 2-(3-methylphenoxy)-N-[(E)-(4-morpholino-3-nitro-benzylidene)amino]acetamide Formula: C20H22N4O5 MolecularWeight: 398.41248

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCC(=O)NN=CC2=CC(=C(C=C2)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)OCC(=O)N/N=C/C2=CC(=C(C=C2)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C20H22N4O5/c1-15-3-2-4-17(11-15)29-14-20(25)22-21-13-16-5-6-18(19(12-16)24(26)27)23-7-9-28-10-8-23/h2-6,11-13H,7-10,14H2,1H3,(H,22,25)/b21-13+