3-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylamino]azepan-2-one

Systemtic Name: 3-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylamino]azepan-2-one Openeye Name: 3-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylamino]azepan-2-one CAS Name: 3-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylamino]-2-azepanone IUPAC Name: 3-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylamino]azepan-2-one Traditional Name: 3-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylamino]azepan-2-one Formula: C16H22N2O3 MolecularWeight: 290.35748

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCCO2)NC3CCCCNC3=O

Isomeric SMILES

CC(C1=CC2=C(C=C1)OCCO2)NC3CCCCNC3=O

InChI

InChI=1S/C16H22N2O3/c1-11(18-13-4-2-3-7-17-16(13)19)12-5-6-14-15(10-12)21-9-8-20-14/h5-6,10-11,13,18H,2-4,7-9H2,1H3,(H,17,19)