(E)-1-(5-morpholin-4-ylsulfonyl-2,3-dihydroindol-1-yl)-3-(4-nitrophenyl)prop-2-en-1-one

Systemtic Name: (E)-1-(5-morpholin-4-ylsulfonyl-2,3-dihydroindol-1-yl)-3-(4-nitrophenyl)prop-2-en-1-one Openeye Name: (E)-1-(5-morpholinosulfonylindolin-1-yl)-3-(4-nitrophenyl)prop-2-en-1-one CAS Name: (E)-1-[5-(4-morpholinylsulfonyl)-2,3-dihydroindol-1-yl]-3-(4-nitrophenyl)-2-propen-1-one IUPAC Name: (E)-1-(5-morpholin-4-ylsulfonyl-2,3-dihydroindol-1-yl)-3-(4-nitrophenyl)prop-2-en-1-one Traditional Name: (E)-1-(5-morpholinosulfonylindolin-1-yl)-3-(4-nitrophenyl)prop-2-en-1-one Formula: C21H21N3O6S MolecularWeight: 443.47294

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=C1C=C(C=C2)S(=O)(=O)N3CCOCC3)C(=O)C=CC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(C2=C1C=C(C=C2)S(=O)(=O)N3CCOCC3)C(=O)/C=C/C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H21N3O6S/c25-21(8-3-16-1-4-18(5-2-16)24(26)27)23-10-9-17-15-19(6-7-20(17)23)31(28,29)22-11-13-30-14-12-22/h1-8,15H,9-14H2/b8-3+