(4-aminocarbonylphenyl)methyl 3-(2-chlorophenyl)sulfanylpropanoate

Systemtic Name: (4-aminocarbonylphenyl)methyl 3-(2-chlorophenyl)sulfanylpropanoate Openeye Name: (4-carbamoylphenyl)methyl 3-(2-chlorophenyl)sulfanylpropanoate CAS Name: 3-[(2-chlorophenyl)thio]propanoic acid (4-carbamoylphenyl)methyl ester IUPAC Name: (4-carbamoylphenyl)methyl 3-(2-chlorophenyl)sulfanylpropanoate Traditional Name: 3-[(2-chlorophenyl)thio]propionic acid (4-carbamoylbenzyl) ester Formula: C17H16ClNO3S MolecularWeight: 349.83184

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)SCCC(=O)OCC2=CC=C(C=C2)C(=O)N)Cl

Isomeric SMILES

C1=CC=C(C(=C1)SCCC(=O)OCC2=CC=C(C=C2)C(=O)N)Cl

InChI

InChI=1S/C17H16ClNO3S/c18-14-3-1-2-4-15(14)23-10-9-16(20)22-11-12-5-7-13(8-6-12)17(19)21/h1-8H,9-11H2,(H2,19,21)