3-[(E)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)prop-2-enoyl]-4-oxidanyl-benzenecarbonitrile

Systemtic Name: 3-[(E)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)prop-2-enoyl]-4-oxidanyl-benzenecarbonitrile Openeye Name: 3-[(E)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)prop-2-enoyl]-4-hydroxy-benzonitrile CAS Name: 3-[(E)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-oxoprop-2-enyl]-4-hydroxybenzonitrile IUPAC Name: 3-[(E)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)prop-2-enoyl]-4-hydroxybenzonitrile Traditional Name: 3-[(E)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)acryloyl]-4-hydroxy-benzonitrile Formula: C18H13NO4 MolecularWeight: 307.30012

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)C=CC(=O)C3=C(C=CC(=C3)C#N)O

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)/C=C/C(=O)C3=C(C=CC(=C3)C#N)O

InChI

InChI=1S/C18H13NO4/c19-11-13-2-5-16(21)14(9-13)15(20)4-1-12-3-6-17-18(10-12)23-8-7-22-17/h1-6,9-10,21H,7-8H2/b4-1+