methyl 4-tert-butyl-6-chloranyl-4-phenyl-1,3-benzodioxine-2-carboxylate

Systemtic Name: methyl 4-tert-butyl-6-chloranyl-4-phenyl-1,3-benzodioxine-2-carboxylate Openeye Name: methyl 4-tert-butyl-6-chloro-4-phenyl-1,3-benzodioxine-2-carboxylate CAS Name: 4-tert-butyl-6-chloro-4-phenyl-1,3-benzodioxin-2-carboxylic acid methyl ester IUPAC Name: methyl 4-tert-butyl-6-chloro-4-phenyl-1,3-benzodioxine-2-carboxylate Traditional Name: 4-tert-butyl-6-chloro-4-phenyl-1,3-benzodioxin-2-carboxylic acid methyl ester Formula: C20H21ClO4 MolecularWeight: 360.83134

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1(C2=C(C=CC(=C2)Cl)OC(O1)C(=O)OC)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C1(C2=C(C=CC(=C2)Cl)OC(O1)C(=O)OC)C3=CC=CC=C3

InChI

InChI=1S/C20H21ClO4/c1-19(2,3)20(13-8-6-5-7-9-13)15-12-14(21)10-11-16(15)24-18(25-20)17(22)23-4/h5-12,18H,1-4H3