1-[[2-[(2-carboxyindol-1-yl)carbamoyl]-1H-indol-5-yl]carbonylamino]indole-2-carboxylic acid

Systemtic Name: 1-[[2-[(2-carboxyindol-1-yl)carbamoyl]-1H-indol-5-yl]carbonylamino]indole-2-carboxylic acid Openeye Name: 1-[[2-[(2-carboxyindol-1-yl)carbamoyl]-1H-indole-5-carbonyl]amino]indole-2-carboxylic acid CAS Name: 1-[[[2-[[(2-carboxy-1-indolyl)amino]-oxomethyl]-1H-indol-5-yl]-oxomethyl]amino]-2-indolecarboxylic acid IUPAC Name: 1-[[2-[(2-carboxyindol-1-yl)carbamoyl]-1H-indole-5-carbonyl]amino]indole-2-carboxylic acid Traditional Name: 1-[[2-[(2-carboxyindol-1-yl)carbamoyl]-1H-indole-5-carbonyl]amino]indole-2-carboxylic acid Formula: C28H19N5O6 MolecularWeight: 521.48036

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(N2NC(=O)C3=CC4=C(C=C3)NC(=C4)C(=O)NN5C6=CC=CC=C6C=C5C(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=C(N2NC(=O)C3=CC4=C(C=C3)NC(=C4)C(=O)NN5C6=CC=CC=C6C=C5C(=O)O)C(=O)O

InChI

InChI=1S/C28H19N5O6/c34-25(30-32-21-7-3-1-5-15(21)13-23(32)27(36)37)17-9-10-19-18(11-17)12-20(29-19)26(35)31-33-22-8-4-2-6-16(22)14-24(33)28(38)39/h1-14,29H,(H,30,34)(H,31,35)(H,36,37)(H,38,39)