(2-chloranyl-4-cyano-phenyl) (3S)-2,3-dihydro-1,4-benzodioxine-3-carboxylate

Systemtic Name: (2-chloranyl-4-cyano-phenyl) (3S)-2,3-dihydro-1,4-benzodioxine-3-carboxylate Openeye Name: (2-chloro-4-cyano-phenyl) (3S)-2,3-dihydro-1,4-benzodioxine-3-carboxylate CAS Name: (3S)-2,3-dihydro-1,4-benzodioxin-3-carboxylic acid (2-chloro-4-cyanophenyl) ester IUPAC Name: (2-chloro-4-cyanophenyl) (3S)-2,3-dihydro-1,4-benzodioxine-3-carboxylate Traditional Name: (3S)-2,3-dihydro-1,4-benzodioxin-3-carboxylic acid (2-chloro-4-cyano-phenyl) ester Formula: C16H10ClNO4 MolecularWeight: 315.7079

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H10ClNO4/c17-11-7-10(8-18)5-6-12(11)22-16(19)15-9-20-13-3-1-2-4-14(13)21-15/h1-7,15H,9H2/t15-/m0/s1