ethyl 4-[(4-chlorophenyl)-oxidanyl-methyl]-4-di(propan-2-yloxy)phosphoryl-pyridine-1-carboxylate

Systemtic Name: ethyl 4-[(4-chlorophenyl)-oxidanyl-methyl]-4-di(propan-2-yloxy)phosphoryl-pyridine-1-carboxylate Openeye Name: ethyl 4-[(4-chlorophenyl)-hydroxy-methyl]-4-diisopropoxyphosphoryl-pyridine-1-carboxylate CAS Name: 4-[(4-chlorophenyl)-hydroxymethyl]-4-di(propan-2-yloxy)phosphoryl-1-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(4-chlorophenyl)-hydroxymethyl]-4-di(propan-2-yloxy)phosphorylpyridine-1-carboxylate Traditional Name: 4-[(4-chlorophenyl)-hydroxy-methyl]-4-diisopropoxyphosphoryl-pyridine-1-carboxylic acid ethyl ester Formula: C21H29ClNO6P MolecularWeight: 457.884821

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C=CC(C=C1)(C(C2=CC=C(C=C2)Cl)O)P(=O)(OC(C)C)OC(C)C

Isomeric SMILES

CCOC(=O)N1C=CC(C=C1)(C(C2=CC=C(C=C2)Cl)O)P(=O)(OC(C)C)OC(C)C

InChI

InChI=1S/C21H29ClNO6P/c1-6-27-20(25)23-13-11-21(12-14-23,19(24)17-7-9-18(22)10-8-17)30(26,28-15(2)3)29-16(4)5/h7-16,19,24H,6H2,1-5H3