(4-cyanophenyl) (3S)-2,3-dihydro-1,4-benzodioxine-3-carboxylate

Systemtic Name: (4-cyanophenyl) (3S)-2,3-dihydro-1,4-benzodioxine-3-carboxylate Openeye Name: (4-cyanophenyl) (3S)-2,3-dihydro-1,4-benzodioxine-3-carboxylate CAS Name: (3S)-2,3-dihydro-1,4-benzodioxin-3-carboxylic acid (4-cyanophenyl) ester IUPAC Name: (4-cyanophenyl) (3S)-2,3-dihydro-1,4-benzodioxine-3-carboxylate Traditional Name: (3S)-2,3-dihydro-1,4-benzodioxin-3-carboxylic acid (4-cyanophenyl) ester Formula: C16H11NO4 MolecularWeight: 281.26284

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2O1)C(=O)OC3=CC=C(C=C3)C#N

Isomeric SMILES

C1[C@H](OC2=CC=CC=C2O1)C(=O)OC3=CC=C(C=C3)C#N

InChI

InChI=1S/C16H11NO4/c17-9-11-5-7-12(8-6-11)20-16(18)15-10-19-13-3-1-2-4-14(13)21-15/h1-8,15H,10H2/t15-/m0/s1