N-methyl-N-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]-2-morpholin-4-yl-5-nitro-benzamide

Systemtic Name: N-methyl-N-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]-2-morpholin-4-yl-5-nitro-benzamide Openeye Name: N-methyl-N-[2-(4-methylanilino)-2-oxo-ethyl]-2-morpholino-5-nitro-benzamide CAS Name: N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]-2-(4-morpholinyl)-5-nitrobenzamide IUPAC Name: N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]-2-morpholin-4-yl-5-nitrobenzamide Traditional Name: N-[2-keto-2-(p-toluidino)ethyl]-N-methyl-2-morpholino-5-nitro-benzamide Formula: C21H24N4O5 MolecularWeight: 412.43906

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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