(2R)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[(2S)-octan-2-yl]pyrrolidine-2-carboxamide

Systemtic Name: (2R)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[(2S)-octan-2-yl]pyrrolidine-2-carboxamide Openeye Name: (2R)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[(1S)-1-methylheptyl]pyrrolidine-2-carboxamide CAS Name: (2R)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[(2S)-octan-2-yl]-2-pyrrolidinecarboxamide IUPAC Name: (2R)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[(2S)-octan-2-yl]pyrrolidine-2-carboxamide Traditional Name: (2R)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[(1S)-1-methylheptyl]pyrrolidine-2-carboxamide Formula: C21H32N2O5S MolecularWeight: 424.55418

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)NC(=O)C1CCCN1S(=O)(=O)C2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CCCCCC[C@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)C2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C21H32N2O5S/c1-3-4-5-6-8-16(2)22-21(24)18-9-7-12-23(18)29(25,26)17-10-11-19-20(15-17)28-14-13-27-19/h10-11,15-16,18H,3-9,12-14H2,1-2H3,(H,22,24)/t16-,18+/m0/s1