1-(1,3-benzodioxol-5-yl)but-3-enyl 1-methyl-3-propan-2-yl-cyclopentane-1-carboxylate

Systemtic Name: 1-(1,3-benzodioxol-5-yl)but-3-enyl 1-methyl-3-propan-2-yl-cyclopentane-1-carboxylate Openeye Name: 1-(1,3-benzodioxol-5-yl)but-3-enyl 3-isopropyl-1-methyl-cyclopentanecarboxylate CAS Name: 1-methyl-3-propan-2-yl-1-cyclopentanecarboxylic acid 1-(1,3-benzodioxol-5-yl)but-3-enyl ester IUPAC Name: 1-(1,3-benzodioxol-5-yl)but-3-enyl 1-methyl-3-propan-2-ylcyclopentane-1-carboxylate Traditional Name: 3-isopropyl-1-methyl-cyclopentanecarboxylic acid 1-(1,3-benzodioxol-5-yl)but-3-enyl ester Formula: C21H28O4 MolecularWeight: 344.44462

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1CCC(C1)(C)C(=O)OC(CC=C)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC(C)C1CCC(C1)(C)C(=O)OC(CC=C)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C21H28O4/c1-5-6-17(15-7-8-18-19(11-15)24-13-23-18)25-20(22)21(4)10-9-16(12-21)14(2)3/h5,7-8,11,14,16-17H,1,6,9-10,12-13H2,2-4H3