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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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