4-(2-carboxyethyl)-5-[(E)-(6-methoxy-2-oxidanylidene-1H-indol-3-ylidene)methyl]-3-methyl-1H-pyrrole-2-carboxylic acid

Systemtic Name: 4-(2-carboxyethyl)-5-[(E)-(6-methoxy-2-oxidanylidene-1H-indol-3-ylidene)methyl]-3-methyl-1H-pyrrole-2-carboxylic acid Openeye Name: 4-(2-carboxyethyl)-5-[(E)-(6-methoxy-2-oxo-indolin-3-ylidene)methyl]-3-methyl-1H-pyrrole-2-carboxylic acid CAS Name: 4-(2-carboxyethyl)-5-[(E)-(6-methoxy-2-oxo-1H-indol-3-ylidene)methyl]-3-methyl-1H-pyrrole-2-carboxylic acid IUPAC Name: 4-(2-carboxyethyl)-5-[(E)-(6-methoxy-2-oxo-1H-indol-3-ylidene)methyl]-3-methyl-1H-pyrrole-2-carboxylic acid Traditional Name: 4-(2-carboxyethyl)-5-[(E)-(2-keto-6-methoxy-indolin-3-ylidene)methyl]-3-methyl-1H-pyrrole-2-carboxylic acid Formula: C19H18N2O6 MolecularWeight: 370.35602

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1CCC(=O)O)C=C2C3=C(C=C(C=C3)OC)NC2=O)C(=O)O

Isomeric SMILES

CC1=C(NC(=C1CCC(=O)O)/C=C/2\C3=C(C=C(C=C3)OC)NC2=O)C(=O)O

InChI

InChI=1S/C19H18N2O6/c1-9-11(5-6-16(22)23)15(20-17(9)19(25)26)8-13-12-4-3-10(27-2)7-14(12)21-18(13)24/h3-4,7-8,20H,5-6H2,1-2H3,(H,21,24)(H,22,23)(H,25,26)/b13-8+