(2R)-N-(1-adamantylmethyl)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-methyl-pyrrolidine-2-carboxamide

Systemtic Name: (2R)-N-(1-adamantylmethyl)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-methyl-pyrrolidine-2-carboxamide Openeye Name: (2R)-N-(1-adamantylmethyl)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-methyl-pyrrolidine-2-carboxamide CAS Name: (2R)-N-(1-adamantylmethyl)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-methyl-2-pyrrolidinecarboxamide IUPAC Name: (2R)-N-(1-adamantylmethyl)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-methylpyrrolidine-2-carboxamide Traditional Name: (2R)-N-(1-adamantylmethyl)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-methyl-pyrrolidine-2-carboxamide Formula: C25H34N2O5S MolecularWeight: 474.61286

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC12CC3CC(C1)CC(C3)C2)C(=O)C4CCCN4S(=O)(=O)C5=CC6=C(C=C5)OCCO6

Isomeric SMILES

CN(CC12CC3CC(C1)CC(C3)C2)C(=O)[C@H]4CCCN4S(=O)(=O)C5=CC6=C(C=C5)OCCO6

InChI

InChI=1S/C25H34N2O5S/c1-26(16-25-13-17-9-18(14-25)11-19(10-17)15-25)24(28)21-3-2-6-27(21)33(29,30)20-4-5-22-23(12-20)32-8-7-31-22/h4-5,12,17-19,21H,2-3,6-11,13-16H2,1H3/t17?,18?,19?,21-,25?/m1/s1