dimethyl 3-[[2-acetamido-3-(1H-indol-3-yl)propanoyl]oxymethyl]-5-azanyl-thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 3-[[2-acetamido-3-(1H-indol-3-yl)propanoyl]oxymethyl]-5-azanyl-thiophene-2,4-dicarboxylate Openeye Name: dimethyl 3-[[2-acetamido-3-(1H-indol-3-yl)propanoyl]oxymethyl]-5-amino-thiophene-2,4-dicarboxylate CAS Name: 3-[[2-acetamido-3-(1H-indol-3-yl)-1-oxopropoxy]methyl]-5-aminothiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 3-[[2-acetamido-3-(1H-indol-3-yl)propanoyl]oxymethyl]-5-aminothiophene-2,4-dicarboxylate Traditional Name: 3-[[2-acetamido-3-(1H-indol-3-yl)propanoyl]oxymethyl]-5-amino-thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C22H23N3O7S MolecularWeight: 473.49892

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)OCC3=C(SC(=C3C(=O)OC)N)C(=O)OC

Isomeric SMILES

CC(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)OCC3=C(SC(=C3C(=O)OC)N)C(=O)OC

InChI

InChI=1S/C22H23N3O7S/c1-11(26)25-16(8-12-9-24-15-7-5-4-6-13(12)15)20(27)32-10-14-17(21(28)30-2)19(23)33-18(14)22(29)31-3/h4-7,9,16,24H,8,10,23H2,1-3H3,(H,25,26)