7-oxabicyclo[4.1.0]hepta-2,4-dien-5-ylmethyl 2-cyclopentyl-4-(2,6-dimethoxyphenyl)-4-oxidanylidene-2-phosphanyl-butanoate

Systemtic Name: 7-oxabicyclo[4.1.0]hepta-2,4-dien-5-ylmethyl 2-cyclopentyl-4-(2,6-dimethoxyphenyl)-4-oxidanylidene-2-phosphanyl-butanoate Openeye Name: 7-oxabicyclo[4.1.0]hepta-2,4-dien-5-ylmethyl 2-cyclopentyl-4-(2,6-dimethoxyphenyl)-4-oxo-2-phosphanyl-butanoate CAS Name: 2-cyclopentyl-4-(2,6-dimethoxyphenyl)-4-oxo-2-phosphinobutanoic acid 7-oxabicyclo[4.1.0]hepta-2,4-dien-5-ylmethyl ester IUPAC Name: 7-oxabicyclo[4.1.0]hepta-2,4-dien-5-ylmethyl 2-cyclopentyl-4-(2,6-dimethoxyphenyl)-4-oxo-2-phosphanylbutanoate Traditional Name: 2-cyclopentyl-4-(2,6-dimethoxyphenyl)-4-keto-2-phosphino-butyric acid 7-oxabicyclo[4.1.0]hepta-2,4-dien-5-ylmethyl ester Formula: C24H29O6P MolecularWeight: 444.457221

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC=C1)OC)C(=O)CC(C2CCCC2)(C(=O)OCC3=CC=CC4C3O4)P

Isomeric SMILES

COC1=C(C(=CC=C1)OC)C(=O)CC(C2CCCC2)(C(=O)OCC3=CC=CC4C3O4)P

InChI

InChI=1S/C24H29O6P/c1-27-18-10-6-11-19(28-2)21(18)17(25)13-24(31,16-8-3-4-9-16)23(26)29-14-15-7-5-12-20-22(15)30-20/h5-7,10-12,16,20,22H,3-4,8-9,13-14,31H2,1-2H3