5-[1-[2-(2-methoxycarbonyl-3-oxidanyl-phenoxy)ethyl]indol-6-yl]-1,2-oxazole-3-carboxylic acid

Systemtic Name: 5-[1-[2-(2-methoxycarbonyl-3-oxidanyl-phenoxy)ethyl]indol-6-yl]-1,2-oxazole-3-carboxylic acid Openeye Name: 5-[1-[2-(3-hydroxy-2-methoxycarbonyl-phenoxy)ethyl]indol-6-yl]isoxazole-3-carboxylic acid CAS Name: 5-[1-[2-(3-hydroxy-2-methoxycarbonylphenoxy)ethyl]-6-indolyl]-3-isoxazolecarboxylic acid IUPAC Name: 5-[1-[2-(3-hydroxy-2-methoxycarbonylphenoxy)ethyl]indol-6-yl]-1,2-oxazole-3-carboxylic acid Traditional Name: 5-[1-[2-(2-carbomethoxy-3-hydroxy-phenoxy)ethyl]indol-6-yl]isoxazole-3-carboxylic acid Formula: C22H18N2O7 MolecularWeight: 422.38752

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC=C1OCCN2C=CC3=C2C=C(C=C3)C4=CC(=NO4)C(=O)O)O

Isomeric SMILES

COC(=O)C1=C(C=CC=C1OCCN2C=CC3=C2C=C(C=C3)C4=CC(=NO4)C(=O)O)O

InChI

InChI=1S/C22H18N2O7/c1-29-22(28)20-17(25)3-2-4-18(20)30-10-9-24-8-7-13-5-6-14(11-16(13)24)19-12-15(21(26)27)23-31-19/h2-8,11-12,25H,9-10H2,1H3,(H,26,27)