3-acetamido-N-[(4-morpholin-4-yl-3-nitro-phenyl)methylideneamino]benzamide

Systemtic Name: 3-acetamido-N-[(4-morpholin-4-yl-3-nitro-phenyl)methylideneamino]benzamide Openeye Name: 3-acetamido-N-[(4-morpholino-3-nitro-phenyl)methyleneamino]benzamide CAS Name: 3-acetamido-N-[[4-(4-morpholinyl)-3-nitrophenyl]methylideneamino]benzamide IUPAC Name: 3-acetamido-N-[(4-morpholin-4-yl-3-nitrophenyl)methylideneamino]benzamide Traditional Name: 3-acetamido-N-[(4-morpholino-3-nitro-benzylidene)amino]benzamide Formula: C20H21N5O5 MolecularWeight: 411.41124

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC(=C1)C(=O)NN=CC2=CC(=C(C=C2)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

CC(=O)NC1=CC=CC(=C1)C(=O)NN=CC2=CC(=C(C=C2)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C20H21N5O5/c1-14(26)22-17-4-2-3-16(12-17)20(27)23-21-13-15-5-6-18(19(11-15)25(28)29)24-7-9-30-10-8-24/h2-6,11-13H,7-10H2,1H3,(H,22,26)(H,23,27)