3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)azepan-2-one

Systemtic Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)azepan-2-one Openeye Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)azepan-2-one CAS Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-azepanone IUPAC Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)azepan-2-one Traditional Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)azepan-2-one Formula: C14H18N2O3 MolecularWeight: 262.30432

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)NC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

C1CCNC(=O)C(C1)NC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C14H18N2O3/c17-14-11(3-1-2-6-15-14)16-10-4-5-12-13(9-10)19-8-7-18-12/h4-5,9,11,16H,1-3,6-8H2,(H,15,17)