2-diethylaminoethyl 4-(2-diphenylphosphorylethanoylamino)benzoate

Systemtic Name: 2-diethylaminoethyl 4-(2-diphenylphosphorylethanoylamino)benzoate Openeye Name: 2-diethylaminoethyl 4-[(2-diphenylphosphorylacetyl)amino]benzoate CAS Name: 4-[(2-diphenylphosphoryl-1-oxoethyl)amino]benzoic acid 2-diethylaminoethyl ester IUPAC Name: 2-diethylaminoethyl 4-[(2-diphenylphosphorylacetyl)amino]benzoate Traditional Name: 4-[(2-diphenylphosphorylacetyl)amino]benzoic acid 2-diethylaminoethyl ester Formula: C27H31N2O4P MolecularWeight: 478.519801

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC(=O)C1=CC=C(C=C1)NC(=O)CP(=O)(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCN(CC)CCOC(=O)C1=CC=C(C=C1)NC(=O)CP(=O)(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C27H31N2O4P/c1-3-29(4-2)19-20-33-27(31)22-15-17-23(18-16-22)28-26(30)21-34(32,24-11-7-5-8-12-24)25-13-9-6-10-14-25/h5-18H,3-4,19-21H2,1-2H3,(H,28,30)