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

Systemtic Name: 1-[[5-(5-chloranylthiophen-2-yl)-1,2-oxazol-3-yl]methyl]-4-methyl-indole-2-carboxylic acid Openeye Name: 1-[[5-(5-chloro-2-thienyl)isoxazol-3-yl]methyl]-4-methyl-indole-2-carboxylic acid CAS Name: 1-[[5-(5-chloro-2-thiophenyl)-3-isoxazolyl]methyl]-4-methyl-2-indolecarboxylic acid IUPAC Name: 1-[[5-(5-chlorothiophen-2-yl)-1,2-oxazol-3-yl]methyl]-4-methylindole-2-carboxylic acid Traditional Name: 1-[[5-(5-chloro-2-thienyl)isoxazol-3-yl]methyl]-4-methyl-indole-2-carboxylic acid Formula: C18H13ClN2O3S MolecularWeight: 372.82542

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=C(N(C2=CC=C1)CC3=NOC(=C3)C4=CC=C(S4)Cl)C(=O)O

Isomeric SMILES

CC1=C2C=C(N(C2=CC=C1)CC3=NOC(=C3)C4=CC=C(S4)Cl)C(=O)O

InChI

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