methyl 4-[5-chloranyl-1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]indol-2-yl]butanoate

Systemtic Name: methyl 4-[5-chloranyl-1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]indol-2-yl]butanoate Openeye Name: methyl 4-[5-chloro-1-(3,5-dimethylisoxazol-4-yl)sulfonyl-indol-2-yl]butanoate CAS Name: 4-[5-chloro-1-[(3,5-dimethyl-4-isoxazolyl)sulfonyl]-2-indolyl]butanoic acid methyl ester IUPAC Name: methyl 4-[5-chloro-1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]indol-2-yl]butanoate Traditional Name: 4-[5-chloro-1-(3,5-dimethylisoxazol-4-yl)sulfonyl-indol-2-yl]butyric acid methyl ester Formula: C18H19ClN2O5S MolecularWeight: 410.87186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)S(=O)(=O)N2C3=C(C=C(C=C3)Cl)C=C2CCCC(=O)OC

Isomeric SMILES

CC1=C(C(=NO1)C)S(=O)(=O)N2C3=C(C=C(C=C3)Cl)C=C2CCCC(=O)OC

InChI

InChI=1S/C18H19ClN2O5S/c1-11-18(12(2)26-20-11)27(23,24)21-15(5-4-6-17(22)25-3)10-13-9-14(19)7-8-16(13)21/h7-10H,4-6H2,1-3H3