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

Systemtic Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)azepan-2-one Openeye Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)azepan-2-one CAS Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)-2-azepanone IUPAC Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)azepan-2-one Traditional Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)azepan-2-one Formula: C15H20N2O3 MolecularWeight: 276.3309

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)NCC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

C1CCNC(=O)C(C1)NCC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C15H20N2O3/c18-15-12(3-1-2-6-16-15)17-10-11-4-5-13-14(9-11)20-8-7-19-13/h4-5,9,12,17H,1-3,6-8,10H2,(H,16,18)