6-[3,4-bis(oxidanyl)pyrrolidin-1-yl]carbonyl-3,4,5a,6-tetrahydro-2H-1,5-benzodioxepine-2-carboxamide

Systemtic Name: 6-[3,4-bis(oxidanyl)pyrrolidin-1-yl]carbonyl-3,4,5a,6-tetrahydro-2H-1,5-benzodioxepine-2-carboxamide Openeye Name: 6-(3,4-dihydroxypyrrolidine-1-carbonyl)-3,4,5a,6-tetrahydro-2H-1,5-benzodioxepine-2-carboxamide CAS Name: 6-[(3,4-dihydroxy-1-pyrrolidinyl)-oxomethyl]-3,4,5a,6-tetrahydro-2H-1,5-benzodioxepin-2-carboxamide IUPAC Name: 6-(3,4-dihydroxypyrrolidine-1-carbonyl)-3,4,5a,6-tetrahydro-2H-1,5-benzodioxepine-2-carboxamide Traditional Name: 6-(3,4-dihydroxypyrrolidine-1-carbonyl)-3,4,5a,6-tetrahydro-2H-1,5-benzodioxepin-2-carboxamide Formula: C15H20N2O6 MolecularWeight: 324.3291

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2C(C=CC=C2OC1C(=O)N)C(=O)N3CC(C(C3)O)O

Isomeric SMILES

C1COC2C(C=CC=C2OC1C(=O)N)C(=O)N3CC(C(C3)O)O

InChI

InChI=1S/C15H20N2O6/c16-14(20)12-4-5-22-13-8(2-1-3-11(13)23-12)15(21)17-6-9(18)10(19)7-17/h1-3,8-10,12-13,18-19H,4-7H2,(H2,16,20)