3-(5-chloranylthiophen-2-yl)-1-(1,2-oxazol-5-ylmethyl)indole-2-carboxylic acid

Systemtic Name: 3-(5-chloranylthiophen-2-yl)-1-(1,2-oxazol-5-ylmethyl)indole-2-carboxylic acid Openeye Name: 3-(5-chloro-2-thienyl)-1-(isoxazol-5-ylmethyl)indole-2-carboxylic acid CAS Name: 3-(5-chloro-2-thiophenyl)-1-(5-isoxazolylmethyl)-2-indolecarboxylic acid IUPAC Name: 3-(5-chlorothiophen-2-yl)-1-(1,2-oxazol-5-ylmethyl)indole-2-carboxylic acid Traditional Name: 3-(5-chloro-2-thienyl)-1-(isoxazol-5-ylmethyl)indole-2-carboxylic acid Formula: C17H11ClN2O3S MolecularWeight: 358.79884

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(N2CC3=CC=NO3)C(=O)O)C4=CC=C(S4)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(N2CC3=CC=NO3)C(=O)O)C4=CC=C(S4)Cl

InChI

InChI=1S/C17H11ClN2O3S/c18-14-6-5-13(24-14)15-11-3-1-2-4-12(11)20(16(15)17(21)22)9-10-7-8-19-23-10/h1-8H,9H2,(H,21,22)