dipropan-2-yl 3-methyl-5-[3-(3-nitrophenyl)prop-2-enoylamino]thiophene-2,4-dicarboxylate

Systemtic Name: dipropan-2-yl 3-methyl-5-[3-(3-nitrophenyl)prop-2-enoylamino]thiophene-2,4-dicarboxylate Openeye Name: diisopropyl 3-methyl-5-[3-(3-nitrophenyl)prop-2-enoylamino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[3-(3-nitrophenyl)-1-oxoprop-2-enyl]amino]thiophene-2,4-dicarboxylic acid dipropan-2-yl ester IUPAC Name: dipropan-2-yl 3-methyl-5-[3-(3-nitrophenyl)prop-2-enoylamino]thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-[[3-(3-nitrophenyl)acryloyl]amino]thiophene-2,4-dicarboxylic acid diisopropyl ester Formula: C22H24N2O7S MolecularWeight: 460.50016

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC(C)C)NC(=O)C=CC2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC(C)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC(C)C)NC(=O)C=CC2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC(C)C

InChI

InChI=1S/C22H24N2O7S/c1-12(2)30-21(26)18-14(5)19(22(27)31-13(3)4)32-20(18)23-17(25)10-9-15-7-6-8-16(11-15)24(28)29/h6-13H,1-5H3,(H,23,25)