cyclobutyl 2-[2-(aminomethyl)-3-(4-chlorophenyl)sulfonyl-phenyl]ethanoate

Systemtic Name: cyclobutyl 2-[2-(aminomethyl)-3-(4-chlorophenyl)sulfonyl-phenyl]ethanoate Openeye Name: cyclobutyl 2-[2-(aminomethyl)-3-(4-chlorophenyl)sulfonyl-phenyl]acetate CAS Name: 2-[2-(aminomethyl)-3-(4-chlorophenyl)sulfonylphenyl]acetic acid cyclobutyl ester IUPAC Name: cyclobutyl 2-[2-(aminomethyl)-3-(4-chlorophenyl)sulfonylphenyl]acetate Traditional Name: 2-[2-(aminomethyl)-3-(4-chlorophenyl)sulfonyl-phenyl]acetic acid cyclobutyl ester Formula: C19H20ClNO4S MolecularWeight: 393.8844

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)OC(=O)CC2=C(C(=CC=C2)S(=O)(=O)C3=CC=C(C=C3)Cl)CN

Isomeric SMILES

C1CC(C1)OC(=O)CC2=C(C(=CC=C2)S(=O)(=O)C3=CC=C(C=C3)Cl)CN

InChI

InChI=1S/C19H20ClNO4S/c20-14-7-9-16(10-8-14)26(23,24)18-6-1-3-13(17(18)12-21)11-19(22)25-15-4-2-5-15/h1,3,6-10,15H,2,4-5,11-12,21H2