ethyl 4-diphenylphosphoryl-5-[(4-methylphenyl)amino]hexanoate

Systemtic Name: ethyl 4-diphenylphosphoryl-5-[(4-methylphenyl)amino]hexanoate Openeye Name: ethyl 4-diphenylphosphoryl-5-(4-methylanilino)hexanoate CAS Name: 4-diphenylphosphoryl-5-(4-methylanilino)hexanoic acid ethyl ester IUPAC Name: ethyl 4-diphenylphosphoryl-5-(4-methylanilino)hexanoate Traditional Name: 4-diphenylphosphoryl-5-(p-toluidino)hexanoic acid ethyl ester Formula: C27H32NO3P MolecularWeight: 449.521641

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(C(C)NC1=CC=C(C=C1)C)P(=O)(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)CCC(C(C)NC1=CC=C(C=C1)C)P(=O)(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C27H32NO3P/c1-4-31-27(29)20-19-26(22(3)28-23-17-15-21(2)16-18-23)32(30,24-11-7-5-8-12-24)25-13-9-6-10-14-25/h5-18,22,26,28H,4,19-20H2,1-3H3