(E)-1-(azepan-1-yl)-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)prop-2-en-1-one

Systemtic Name: (E)-1-(azepan-1-yl)-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)prop-2-en-1-one Openeye Name: (E)-1-(azepan-1-yl)-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)prop-2-en-1-one CAS Name: (E)-1-(1-azepanyl)-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)-2-propen-1-one IUPAC Name: (E)-1-(azepan-1-yl)-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)prop-2-en-1-one Traditional Name: (E)-1-(azepan-1-yl)-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)prop-2-en-1-one Formula: C18H23NO4 MolecularWeight: 317.37952

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC2=C1OCCO2)C=CC(=O)N3CCCCCC3

Isomeric SMILES

COC1=CC(=CC2=C1OCCO2)/C=C/C(=O)N3CCCCCC3

InChI

InChI=1S/C18H23NO4/c1-21-15-12-14(13-16-18(15)23-11-10-22-16)6-7-17(20)19-8-4-2-3-5-9-19/h6-7,12-13H,2-5,8-11H2,1H3/b7-6+