N-(3-oxidanylpropyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide

Systemtic Name: N-(3-oxidanylpropyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide Openeye Name: N-(3-hydroxypropyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide CAS Name: N-(3-hydroxypropyl)-3,4-dihydro-2H-1,5-benzodioxepin-7-carboxamide IUPAC Name: N-(3-hydroxypropyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide Traditional Name: N-(3-hydroxypropyl)-3,4-dihydro-2H-1,5-benzodioxepin-7-carboxamide Formula: C13H17NO4 MolecularWeight: 251.27838

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)C(=O)NCCCO)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)C(=O)NCCCO)OC1

InChI

InChI=1S/C13H17NO4/c15-6-1-5-14-13(16)10-3-4-11-12(9-10)18-8-2-7-17-11/h3-4,9,15H,1-2,5-8H2,(H,14,16)