2-diethylaminoethyl 4-[2,2-bis(4-chloranylphenoxy)ethanoylamino]benzoate

Systemtic Name: 2-diethylaminoethyl 4-[2,2-bis(4-chloranylphenoxy)ethanoylamino]benzoate Openeye Name: 2-diethylaminoethyl 4-[[2,2-bis(4-chlorophenoxy)acetyl]amino]benzoate CAS Name: 4-[[2,2-bis(4-chlorophenoxy)-1-oxoethyl]amino]benzoic acid 2-diethylaminoethyl ester IUPAC Name: 2-diethylaminoethyl 4-[[2,2-bis(4-chlorophenoxy)acetyl]amino]benzoate Traditional Name: 4-[[2,2-bis(4-chlorophenoxy)acetyl]amino]benzoic acid 2-diethylaminoethyl ester Formula: C27H28Cl2N2O5 MolecularWeight: 531.42762

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC(=O)C1=CC=C(C=C1)NC(=O)C(OC2=CC=C(C=C2)Cl)OC3=CC=C(C=C3)Cl

Isomeric SMILES

CCN(CC)CCOC(=O)C1=CC=C(C=C1)NC(=O)C(OC2=CC=C(C=C2)Cl)OC3=CC=C(C=C3)Cl

InChI

InChI=1S/C27H28Cl2N2O5/c1-3-31(4-2)17-18-34-26(33)19-5-11-22(12-6-19)30-25(32)27(35-23-13-7-20(28)8-14-23)36-24-15-9-21(29)10-16-24/h5-16,27H,3-4,17-18H2,1-2H3,(H,30,32)