(E)-2-(4-tert-butylphenyl)carbonyl-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)prop-2-enenitrile

Systemtic Name: (E)-2-(4-tert-butylphenyl)carbonyl-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)prop-2-enenitrile Openeye Name: (E)-2-(4-tert-butylbenzoyl)-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)prop-2-enenitrile CAS Name: (E)-2-[(4-tert-butylphenyl)-oxomethyl]-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)-2-propenenitrile IUPAC Name: (E)-2-(4-tert-butylbenzoyl)-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)prop-2-enenitrile Traditional Name: (E)-2-(4-tert-butylbenzoyl)-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)acrylonitrile Formula: C23H23NO4 MolecularWeight: 377.43302

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H23NO4/c1-23(2,3)18-7-5-16(6-8-18)21(25)17(14-24)11-15-12-19(26-4)22-20(13-15)27-9-10-28-22/h5-8,11-13H,9-10H2,1-4H3/b17-11+