1-[[5-(5-chloranylthiophen-2-yl)-1,2-oxazol-3-yl]methyl]-7-methyl-indole-2-carboxylic acid

Systemtic Name: 1-[[5-(5-chloranylthiophen-2-yl)-1,2-oxazol-3-yl]methyl]-7-methyl-indole-2-carboxylic acid Openeye Name: 1-[[5-(5-chloro-2-thienyl)isoxazol-3-yl]methyl]-7-methyl-indole-2-carboxylic acid CAS Name: 1-[[5-(5-chloro-2-thiophenyl)-3-isoxazolyl]methyl]-7-methyl-2-indolecarboxylic acid IUPAC Name: 1-[[5-(5-chlorothiophen-2-yl)-1,2-oxazol-3-yl]methyl]-7-methylindole-2-carboxylic acid Traditional Name: 1-[[5-(5-chloro-2-thienyl)isoxazol-3-yl]methyl]-7-methyl-indole-2-carboxylic acid Formula: C18H13ClN2O3S MolecularWeight: 372.82542

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N(C(=C2)C(=O)O)CC3=NOC(=C3)C4=CC=C(S4)Cl

Isomeric SMILES

CC1=CC=CC2=C1N(C(=C2)C(=O)O)CC3=NOC(=C3)C4=CC=C(S4)Cl

InChI

InChI=1S/C18H13ClN2O3S/c1-10-3-2-4-11-7-13(18(22)23)21(17(10)11)9-12-8-14(24-20-12)15-5-6-16(19)25-15/h2-8H,9H2,1H3,(H,22,23)