(4-nitrophenyl)methyl 3-(4-chlorophenyl)sulfanylpropanoate

Systemtic Name: (4-nitrophenyl)methyl 3-(4-chlorophenyl)sulfanylpropanoate Openeye Name: (4-nitrophenyl)methyl 3-(4-chlorophenyl)sulfanylpropanoate CAS Name: 3-[(4-chlorophenyl)thio]propanoic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 3-(4-chlorophenyl)sulfanylpropanoate Traditional Name: 3-[(4-chlorophenyl)thio]propionic acid (4-nitrobenzyl) ester Formula: C16H14ClNO4S MolecularWeight: 351.80466

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1COC(=O)CCSC2=CC=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1COC(=O)CCSC2=CC=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H14ClNO4S/c17-13-3-7-15(8-4-13)23-10-9-16(19)22-11-12-1-5-14(6-2-12)18(20)21/h1-8H,9-11H2