1-[[5-(5-chloranylthiophen-2-yl)-1,2-oxazol-3-yl]methyl]-4,6-dimethoxy-indole-2-carboxylic acid

Systemtic Name: 1-[[5-(5-chloranylthiophen-2-yl)-1,2-oxazol-3-yl]methyl]-4,6-dimethoxy-indole-2-carboxylic acid Openeye Name: 1-[[5-(5-chloro-2-thienyl)isoxazol-3-yl]methyl]-4,6-dimethoxy-indole-2-carboxylic acid CAS Name: 1-[[5-(5-chloro-2-thiophenyl)-3-isoxazolyl]methyl]-4,6-dimethoxy-2-indolecarboxylic acid IUPAC Name: 1-[[5-(5-chlorothiophen-2-yl)-1,2-oxazol-3-yl]methyl]-4,6-dimethoxyindole-2-carboxylic acid Traditional Name: 1-[[5-(5-chloro-2-thienyl)isoxazol-3-yl]methyl]-4,6-dimethoxy-indole-2-carboxylic acid Formula: C19H15ClN2O5S MolecularWeight: 418.8508

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C2C=C(N(C2=C1)CC3=NOC(=C3)C4=CC=C(S4)Cl)C(=O)O)OC

Isomeric SMILES

COC1=CC(=C2C=C(N(C2=C1)CC3=NOC(=C3)C4=CC=C(S4)Cl)C(=O)O)OC

InChI

InChI=1S/C19H15ClN2O5S/c1-25-11-6-13-12(15(7-11)26-2)8-14(19(23)24)22(13)9-10-5-16(27-21-10)17-3-4-18(20)28-17/h3-8H,9H2,1-2H3,(H,23,24)