3-[(2-carboxy-1H-indol-3-yl)-thiophen-2-yl-methyl]-1H-indole-2-carboxylic acid

Systemtic Name: 3-[(2-carboxy-1H-indol-3-yl)-thiophen-2-yl-methyl]-1H-indole-2-carboxylic acid Openeye Name: 3-[(2-carboxy-1H-indol-3-yl)-(2-thienyl)methyl]-1H-indole-2-carboxylic acid CAS Name: 3-[(2-carboxy-1H-indol-3-yl)-thiophen-2-ylmethyl]-1H-indole-2-carboxylic acid IUPAC Name: 3-[(2-carboxy-1H-indol-3-yl)-thiophen-2-ylmethyl]-1H-indole-2-carboxylic acid Traditional Name: 3-[(2-carboxy-1H-indol-3-yl)-(2-thienyl)methyl]-1H-indole-2-carboxylic acid Formula: C23H16N2O4S MolecularWeight: 416.44914

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(N2)C(=O)O)C(C3=CC=CS3)C4=C(NC5=CC=CC=C54)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(N2)C(=O)O)C(C3=CC=CS3)C4=C(NC5=CC=CC=C54)C(=O)O

InChI

InChI=1S/C23H16N2O4S/c26-22(27)20-17(12-6-1-3-8-14(12)24-20)19(16-10-5-11-30-16)18-13-7-2-4-9-15(13)25-21(18)23(28)29/h1-11,19,24-25H,(H,26,27)(H,28,29)