(furan-2-ylmethylamino) 4-chloranyl-2-(2-diethylaminoethyl)-5-methylsulfonyl-benzoate

Systemtic Name: (furan-2-ylmethylamino) 4-chloranyl-2-(2-diethylaminoethyl)-5-methylsulfonyl-benzoate Openeye Name: (2-furylmethylamino) 4-chloro-2-(2-diethylaminoethyl)-5-methylsulfonyl-benzoate CAS Name: 4-chloro-2-(2-diethylaminoethyl)-5-methylsulfonylbenzoic acid (2-furanylmethylamino) ester IUPAC Name: (furan-2-ylmethylamino) 4-chloro-2-(2-diethylaminoethyl)-5-methylsulfonylbenzoate Traditional Name: 4-chloro-2-(2-diethylaminoethyl)-5-mesyl-benzoic acid (2-furfurylamino) ester Formula: C19H25ClN2O5S MolecularWeight: 428.9302

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCC1=CC(=C(C=C1C(=O)ONCC2=CC=CO2)S(=O)(=O)C)Cl

Isomeric SMILES

CCN(CC)CCC1=CC(=C(C=C1C(=O)ONCC2=CC=CO2)S(=O)(=O)C)Cl

InChI

InChI=1S/C19H25ClN2O5S/c1-4-22(5-2)9-8-14-11-17(20)18(28(3,24)25)12-16(14)19(23)27-21-13-15-7-6-10-26-15/h6-7,10-12,21H,4-5,8-9,13H2,1-3H3