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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H31O6P/c1-4-5-8-14-28-21(25)22(29,15-10-6-7-11-15)20(24)19(23)18-16(26-2)12-9-13-17(18)27-3/h9,12-13,15H,4-8,10-11,14,29H2,1-3H3