4-ethyl-2-[[(4-methoxyphenyl)amino]methyl]-5-[(2-methylpropan-2-yl)oxycarbonyl]-1H-pyrrole-3-carboxylic acid

Systemtic Name: 4-ethyl-2-[[(4-methoxyphenyl)amino]methyl]-5-[(2-methylpropan-2-yl)oxycarbonyl]-1H-pyrrole-3-carboxylic acid Openeye Name: 5-tert-butoxycarbonyl-4-ethyl-2-[(4-methoxyanilino)methyl]-1H-pyrrole-3-carboxylic acid CAS Name: 4-ethyl-2-[(4-methoxyanilino)methyl]-5-[(2-methylpropan-2-yl)oxy-oxomethyl]-1H-pyrrole-3-carboxylic acid IUPAC Name: 4-ethyl-2-[(4-methoxyanilino)methyl]-5-[(2-methylpropan-2-yl)oxycarbonyl]-1H-pyrrole-3-carboxylic acid Traditional Name: 5-tert-butoxycarbonyl-4-ethyl-2-(p-anisidinomethyl)-1H-pyrrole-3-carboxylic acid Formula: C20H26N2O5 MolecularWeight: 374.43084

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(NC(=C1C(=O)O)CNC2=CC=C(C=C2)OC)C(=O)OC(C)(C)C

Isomeric SMILES

CCC1=C(NC(=C1C(=O)O)CNC2=CC=C(C=C2)OC)C(=O)OC(C)(C)C

InChI

InChI=1S/C20H26N2O5/c1-6-14-16(18(23)24)15(22-17(14)19(25)27-20(2,3)4)11-21-12-7-9-13(26-5)10-8-12/h7-10,21-22H,6,11H2,1-5H3,(H,23,24)