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

Systemtic Name: 3-methylbutyl 2-cyclopentyl-4-(2,6-dimethoxyphenyl)-3,4-bis(oxidanylidene)-2-phosphanyl-butanoate Openeye Name: isopentyl 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 3-methylbutyl ester IUPAC Name: 3-methylbutyl 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 isoamyl ester Formula: C22H31O6P MolecularWeight: 422.451701

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H31O6P/c1-14(2)12-13-28-21(25)22(29,15-8-5-6-9-15)20(24)19(23)18-16(26-3)10-7-11-17(18)27-4/h7,10-11,14-15H,5-6,8-9,12-13,29H2,1-4H3