2-methylpropyl 2-cyclopentyl-4-(2,6-dimethoxyphenyl)-3,4-bis(oxidanylidene)-2-phosphanyl-butanoate

Systemtic Name: 2-methylpropyl 2-cyclopentyl-4-(2,6-dimethoxyphenyl)-3,4-bis(oxidanylidene)-2-phosphanyl-butanoate Openeye Name: isobutyl 2-cyclopentyl-4-(2,6-dimethoxyphenyl)-3,4-dioxo-2-phosphanyl-butanoate CAS Name: 2-cyclopentyl-4-(2,6-dimethoxyphenyl)-3,4-dioxo-2-phosphinobutanoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 2-cyclopentyl-4-(2,6-dimethoxyphenyl)-3,4-dioxo-2-phosphanylbutanoate Traditional Name: 2-cyclopentyl-4-(2,6-dimethoxyphenyl)-3,4-diketo-2-phosphino-butyric acid isobutyl ester Formula: C21H29O6P MolecularWeight: 408.425121

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)C(C1CCCC1)(C(=O)C(=O)C2=C(C=CC=C2OC)OC)P

Isomeric SMILES

CC(C)COC(=O)C(C1CCCC1)(C(=O)C(=O)C2=C(C=CC=C2OC)OC)P

InChI

InChI=1S/C21H29O6P/c1-13(2)12-27-20(24)21(28,14-8-5-6-9-14)19(23)18(22)17-15(25-3)10-7-11-16(17)26-4/h7,10-11,13-14H,5-6,8-9,12,28H2,1-4H3