2-[[3-(1H-indol-3-yl)-1-oxidanyl-1-oxidanylidene-propan-2-yl]carbamoyl]benzoic acid

Systemtic Name: 2-[[3-(1H-indol-3-yl)-1-oxidanyl-1-oxidanylidene-propan-2-yl]carbamoyl]benzoic acid Openeye Name: 2-[[2-hydroxy-1-(1H-indol-3-ylmethyl)-2-oxo-ethyl]carbamoyl]benzoic acid CAS Name: 2-[[[1-hydroxy-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-oxomethyl]benzoic acid IUPAC Name: 2-[[1-hydroxy-3-(1H-indol-3-yl)-1-oxopropan-2-yl]carbamoyl]benzoic acid Traditional Name: 2-[[2-hydroxy-1-(1H-indol-3-ylmethyl)-2-keto-ethyl]carbamoyl]benzoic acid Formula: C19H16N2O5 MolecularWeight: 352.34074

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CC(C(=O)O)NC(=O)C3=CC=CC=C3C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)CC(C(=O)O)NC(=O)C3=CC=CC=C3C(=O)O

InChI

InChI=1S/C19H16N2O5/c22-17(13-6-1-2-7-14(13)18(23)24)21-16(19(25)26)9-11-10-20-15-8-4-3-5-12(11)15/h1-8,10,16,20H,9H2,(H,21,22)(H,23,24)(H,25,26)