2-diethylaminoethyl 4-[2-(3-chloranylphenoxy)propanoylamino]benzoate

Systemtic Name: 2-diethylaminoethyl 4-[2-(3-chloranylphenoxy)propanoylamino]benzoate Openeye Name: 2-diethylaminoethyl 4-[2-(3-chlorophenoxy)propanoylamino]benzoate CAS Name: 4-[[2-(3-chlorophenoxy)-1-oxopropyl]amino]benzoic acid 2-diethylaminoethyl ester IUPAC Name: 2-diethylaminoethyl 4-[2-(3-chlorophenoxy)propanoylamino]benzoate Traditional Name: 4-[2-(3-chlorophenoxy)propanoylamino]benzoic acid 2-diethylaminoethyl ester Formula: C22H27ClN2O4 MolecularWeight: 418.91378

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27ClN2O4/c1-4-25(5-2)13-14-28-22(27)17-9-11-19(12-10-17)24-21(26)16(3)29-20-8-6-7-18(23)15-20/h6-12,15-16H,4-5,13-14H2,1-3H3,(H,24,26)