5-[(5-carboxy-4-ethyl-3-methyl-1H-pyrrol-2-yl)methyl]-3-ethyl-4-methyl-1H-pyrrole-2-carboxylic acid

Systemtic Name: 5-[(5-carboxy-4-ethyl-3-methyl-1H-pyrrol-2-yl)methyl]-3-ethyl-4-methyl-1H-pyrrole-2-carboxylic acid Openeye Name: 5-[(5-carboxy-4-ethyl-3-methyl-1H-pyrrol-2-yl)methyl]-3-ethyl-4-methyl-1H-pyrrole-2-carboxylic acid CAS Name: 5-[(5-carboxy-4-ethyl-3-methyl-1H-pyrrol-2-yl)methyl]-3-ethyl-4-methyl-1H-pyrrole-2-carboxylic acid IUPAC Name: 5-[(5-carboxy-4-ethyl-3-methyl-1H-pyrrol-2-yl)methyl]-3-ethyl-4-methyl-1H-pyrrole-2-carboxylic acid Traditional Name: 5-[(5-carboxy-4-ethyl-3-methyl-1H-pyrrol-2-yl)methyl]-3-ethyl-4-methyl-1H-pyrrole-2-carboxylic acid Formula: C17H22N2O4 MolecularWeight: 318.36758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(NC(=C1C)CC2=C(C(=C(N2)C(=O)O)CC)C)C(=O)O

Isomeric SMILES

CCC1=C(NC(=C1C)CC2=C(C(=C(N2)C(=O)O)CC)C)C(=O)O

InChI

InChI=1S/C17H22N2O4/c1-5-10-8(3)12(18-14(10)16(20)21)7-13-9(4)11(6-2)15(19-13)17(22)23/h18-19H,5-7H2,1-4H3,(H,20,21)(H,22,23)