N-[3-(2-methylpropanoylamino)phenyl]-2-morpholin-4-yl-5-nitro-benzamide

Systemtic Name: N-[3-(2-methylpropanoylamino)phenyl]-2-morpholin-4-yl-5-nitro-benzamide Openeye Name: N-[3-(2-methylpropanoylamino)phenyl]-2-morpholino-5-nitro-benzamide CAS Name: N-[3-[(2-methyl-1-oxopropyl)amino]phenyl]-2-(4-morpholinyl)-5-nitrobenzamide IUPAC Name: N-[3-(2-methylpropanoylamino)phenyl]-2-morpholin-4-yl-5-nitrobenzamide Traditional Name: N-[3-(isobutyrylamino)phenyl]-2-morpholino-5-nitro-benzamide Formula: C21H24N4O5 MolecularWeight: 412.43906

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24N4O5/c1-14(2)20(26)22-15-4-3-5-16(12-15)23-21(27)18-13-17(25(28)29)6-7-19(18)24-8-10-30-11-9-24/h3-7,12-14H,8-11H2,1-2H3,(H,22,26)(H,23,27)