(E)-1-(azepan-1-yl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)prop-2-en-1-one

Systemtic Name: (E)-1-(azepan-1-yl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)prop-2-en-1-one Openeye Name: (E)-1-(azepan-1-yl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)prop-2-en-1-one CAS Name: (E)-1-(1-azepanyl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-propen-1-one IUPAC Name: (E)-1-(azepan-1-yl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)prop-2-en-1-one Traditional Name: (E)-1-(azepan-1-yl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)prop-2-en-1-one Formula: C17H21NO3 MolecularWeight: 287.35354

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C=CC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

C1CCCN(CC1)C(=O)/C=C/C2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C17H21NO3/c19-17(18-9-3-1-2-4-10-18)8-6-14-5-7-15-16(13-14)21-12-11-20-15/h5-8,13H,1-4,9-12H2/b8-6+