(4-cyanophenyl) 3-(1,3-benzodioxol-5-yl)propanoate

Systemtic Name: (4-cyanophenyl) 3-(1,3-benzodioxol-5-yl)propanoate Openeye Name: (4-cyanophenyl) 3-(1,3-benzodioxol-5-yl)propanoate CAS Name: 3-(1,3-benzodioxol-5-yl)propanoic acid (4-cyanophenyl) ester IUPAC Name: (4-cyanophenyl) 3-(1,3-benzodioxol-5-yl)propanoate Traditional Name: 3-(1,3-benzodioxol-5-yl)propionic acid (4-cyanophenyl) ester Formula: C17H13NO4 MolecularWeight: 295.28942

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CCC(=O)OC3=CC=C(C=C3)C#N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CCC(=O)OC3=CC=C(C=C3)C#N

InChI

InChI=1S/C17H13NO4/c18-10-13-1-5-14(6-2-13)22-17(19)8-4-12-3-7-15-16(9-12)21-11-20-15/h1-3,5-7,9H,4,8,11H2