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

Systemtic Name: cyclopropyl 2-[2-(aminomethyl)-3-(4-chlorophenyl)sulfonyl-phenyl]ethanoate Openeye Name: cyclopropyl 2-[2-(aminomethyl)-3-(4-chlorophenyl)sulfonyl-phenyl]acetate CAS Name: 2-[2-(aminomethyl)-3-(4-chlorophenyl)sulfonylphenyl]acetic acid cyclopropyl ester IUPAC Name: cyclopropyl 2-[2-(aminomethyl)-3-(4-chlorophenyl)sulfonylphenyl]acetate Traditional Name: 2-[2-(aminomethyl)-3-(4-chlorophenyl)sulfonyl-phenyl]acetic acid cyclopropyl ester Formula: C18H18ClNO4S MolecularWeight: 379.85782

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1OC(=O)CC2=C(C(=CC=C2)S(=O)(=O)C3=CC=C(C=C3)Cl)CN

Isomeric SMILES

C1CC1OC(=O)CC2=C(C(=CC=C2)S(=O)(=O)C3=CC=C(C=C3)Cl)CN

InChI

InChI=1S/C18H18ClNO4S/c19-13-4-8-15(9-5-13)25(22,23)17-3-1-2-12(16(17)11-20)10-18(21)24-14-6-7-14/h1-5,8-9,14H,6-7,10-11,20H2