(E)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(3-methylphenyl)carbonyl-prop-2-enenitrile

Systemtic Name: (E)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(3-methylphenyl)carbonyl-prop-2-enenitrile Openeye Name: (E)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(3-methylbenzoyl)prop-2-enenitrile CAS Name: (E)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(3-methylphenyl)-oxomethyl]-2-propenenitrile IUPAC Name: (E)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(3-methylbenzoyl)prop-2-enenitrile Traditional Name: (E)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-m-toluoyl-acrylonitrile Formula: C19H15NO3 MolecularWeight: 305.3273

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)C(=CC2=CC3=C(C=C2)OCCO3)C#N

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)/C(=C/C2=CC3=C(C=C2)OCCO3)/C#N

InChI

InChI=1S/C19H15NO3/c1-13-3-2-4-15(9-13)19(21)16(12-20)10-14-5-6-17-18(11-14)23-8-7-22-17/h2-6,9-11H,7-8H2,1H3/b16-10+