methyl 2-[2-azanyl-4-(chloromethyl)phenyl]sulfanyloxybenzoate

Systemtic Name: methyl 2-[2-azanyl-4-(chloromethyl)phenyl]sulfanyloxybenzoate Openeye Name: methyl 2-[2-amino-4-(chloromethyl)phenyl]sulfanyloxybenzoate CAS Name: 2-[[2-amino-4-(chloromethyl)phenyl]thio]oxybenzoic acid methyl ester IUPAC Name: methyl 2-[2-amino-4-(chloromethyl)phenyl]sulfanyloxybenzoate Traditional Name: 2-[[2-amino-4-(chloromethyl)phenyl]thio]oxybenzoic acid methyl ester Formula: C15H14ClNO3S MolecularWeight: 323.79456

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1OSC2=C(C=C(C=C2)CCl)N

Isomeric SMILES

COC(=O)C1=CC=CC=C1OSC2=C(C=C(C=C2)CCl)N

InChI

InChI=1S/C15H14ClNO3S/c1-19-15(18)11-4-2-3-5-13(11)20-21-14-7-6-10(9-16)8-12(14)17/h2-8H,9,17H2,1H3