N-[4-[2-(methylamino)-2-oxidanylidene-ethyl]phenyl]-2-morpholin-4-yl-5-nitro-benzamide

Systemtic Name: N-[4-[2-(methylamino)-2-oxidanylidene-ethyl]phenyl]-2-morpholin-4-yl-5-nitro-benzamide Openeye Name: N-[4-[2-(methylamino)-2-oxo-ethyl]phenyl]-2-morpholino-5-nitro-benzamide CAS Name: N-[4-[2-(methylamino)-2-oxoethyl]phenyl]-2-(4-morpholinyl)-5-nitrobenzamide IUPAC Name: N-[4-[2-(methylamino)-2-oxoethyl]phenyl]-2-morpholin-4-yl-5-nitrobenzamide Traditional Name: N-[4-[2-keto-2-(methylamino)ethyl]phenyl]-2-morpholino-5-nitro-benzamide Formula: C20H22N4O5 MolecularWeight: 398.41248

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)CC1=CC=C(C=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCOCC3

Isomeric SMILES

CNC(=O)CC1=CC=C(C=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCOCC3

InChI

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