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

Systemtic Name: N-[4-(butanoylamino)phenyl]-4-morpholin-4-yl-3-nitro-benzamide Openeye Name: N-[4-(butanoylamino)phenyl]-4-morpholino-3-nitro-benzamide CAS Name: 4-(4-morpholinyl)-3-nitro-N-[4-(1-oxobutylamino)phenyl]benzamide IUPAC Name: N-[4-(butanoylamino)phenyl]-4-morpholin-4-yl-3-nitrobenzamide Traditional Name: N-(4-butyramidophenyl)-4-morpholino-3-nitro-benzamide Formula: C21H24N4O5 MolecularWeight: 412.43906

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

CCCC(=O)NC1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C21H24N4O5/c1-2-3-20(26)22-16-5-7-17(8-6-16)23-21(27)15-4-9-18(19(14-15)25(28)29)24-10-12-30-13-11-24/h4-9,14H,2-3,10-13H2,1H3,(H,22,26)(H,23,27)