N-[(E)-1-(4-methyl-3-nitro-phenyl)ethylideneamino]-3-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: N-[(E)-1-(4-methyl-3-nitro-phenyl)ethylideneamino]-3-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-[(E)-1-(4-methyl-3-nitro-phenyl)ethylideneamino]-3-morpholinosulfonyl-benzamide CAS Name: N-[(E)-1-(4-methyl-3-nitrophenyl)ethylideneamino]-3-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-[(E)-1-(4-methyl-3-nitrophenyl)ethylideneamino]-3-morpholin-4-ylsulfonylbenzamide Traditional Name: N-[(E)-1-(4-methyl-3-nitro-phenyl)ethylideneamino]-3-morpholinosulfonyl-benzamide Formula: C20H22N4O6S MolecularWeight: 446.47688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=NNC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCOCC3)C)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C20H22N4O6S/c1-14-6-7-16(13-19(14)24(26)27)15(2)21-22-20(25)17-4-3-5-18(12-17)31(28,29)23-8-10-30-11-9-23/h3-7,12-13H,8-11H2,1-2H3,(H,22,25)/b21-15+