ethyl 1-cyclopropyl-2-(furan-2-ylmethylsulfonylmethyl)-5-oxidanyl-4-(pyrrolidin-1-ylmethyl)indole-3-carboxylate

Systemtic Name: ethyl 1-cyclopropyl-2-(furan-2-ylmethylsulfonylmethyl)-5-oxidanyl-4-(pyrrolidin-1-ylmethyl)indole-3-carboxylate Openeye Name: ethyl 1-cyclopropyl-2-(2-furylmethylsulfonylmethyl)-5-hydroxy-4-(pyrrolidin-1-ylmethyl)indole-3-carboxylate CAS Name: 1-cyclopropyl-2-(2-furanylmethylsulfonylmethyl)-5-hydroxy-4-(1-pyrrolidinylmethyl)-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-cyclopropyl-2-(furan-2-ylmethylsulfonylmethyl)-5-hydroxy-4-(pyrrolidin-1-ylmethyl)indole-3-carboxylate Traditional Name: 1-cyclopropyl-2-(2-furfurylsulfonylmethyl)-5-hydroxy-4-(pyrrolidinomethyl)indole-3-carboxylic acid ethyl ester Formula: C25H30N2O6S MolecularWeight: 486.5805

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=C1C(=C(C=C2)O)CN3CCCC3)C4CC4)CS(=O)(=O)CC5=CC=CO5

Isomeric SMILES

CCOC(=O)C1=C(N(C2=C1C(=C(C=C2)O)CN3CCCC3)C4CC4)CS(=O)(=O)CC5=CC=CO5

InChI

InChI=1S/C25H30N2O6S/c1-2-32-25(29)24-21(16-34(30,31)15-18-6-5-13-33-18)27(17-7-8-17)20-9-10-22(28)19(23(20)24)14-26-11-3-4-12-26/h5-6,9-10,13,17,28H,2-4,7-8,11-12,14-16H2,1H3