2-ethylhexanoyl 2-(2,6-dimethoxyphenyl)carbonyl-4,6,6-trimethyl-2-phosphanyl-heptanoate

Systemtic Name: 2-ethylhexanoyl 2-(2,6-dimethoxyphenyl)carbonyl-4,6,6-trimethyl-2-phosphanyl-heptanoate Openeye Name: 2-ethylhexanoyl 2-(2,6-dimethoxybenzoyl)-4,6,6-trimethyl-2-phosphanyl-heptanoate CAS Name: 2-[(2,6-dimethoxyphenyl)-oxomethyl]-4,6,6-trimethyl-2-phosphinoheptanoic acid (2-ethyl-1-oxohexyl) ester IUPAC Name: 2-ethylhexanoyl 2-(2,6-dimethoxybenzoyl)-4,6,6-trimethyl-2-phosphanylheptanoate Traditional Name: 2-(2,6-dimethoxybenzoyl)-4,6,6-trimethyl-2-phosphino-enanthic acid 2-ethylhexanoyl ester Formula: C27H43O6P MolecularWeight: 494.600481

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)OC(=O)C(CC(C)CC(C)(C)C)(C(=O)C1=C(C=CC=C1OC)OC)P

Isomeric SMILES

CCCCC(CC)C(=O)OC(=O)C(CC(C)CC(C)(C)C)(C(=O)C1=C(C=CC=C1OC)OC)P

InChI

InChI=1S/C27H43O6P/c1-9-11-13-19(10-2)24(29)33-25(30)27(34,17-18(3)16-26(4,5)6)23(28)22-20(31-7)14-12-15-21(22)32-8/h12,14-15,18-19H,9-11,13,16-17,34H2,1-8H3