methyl 2-(4-methoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)carbonyl-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-carboxylate

Systemtic Name: methyl 2-(4-methoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)carbonyl-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-carboxylate Openeye Name: methyl 2-(4-methoxy-3-pyrrolidin-1-ylsulfonyl-benzoyl)-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-carboxylate CAS Name: 2-[[4-methoxy-3-(1-pyrrolidinylsulfonyl)phenyl]-oxomethyl]-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-carboxylic acid methyl ester IUPAC Name: methyl 2-(4-methoxy-3-pyrrolidin-1-ylsulfonylbenzoyl)-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-carboxylate Traditional Name: 2-(4-methoxy-3-pyrrolidinosulfonyl-benzoyl)-1,3,4,5-tetrahydropyrid[4,3-b]indole-8-carboxylic acid methyl ester Formula: C25H27N3O6S MolecularWeight: 497.56338

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N2CCC3=C(C2)C4=C(N3)C=CC(=C4)C(=O)OC)S(=O)(=O)N5CCCC5

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N2CCC3=C(C2)C4=C(N3)C=CC(=C4)C(=O)OC)S(=O)(=O)N5CCCC5

InChI

InChI=1S/C25H27N3O6S/c1-33-22-8-6-16(14-23(22)35(31,32)28-10-3-4-11-28)24(29)27-12-9-21-19(15-27)18-13-17(25(30)34-2)5-7-20(18)26-21/h5-8,13-14,26H,3-4,9-12,15H2,1-2H3