methyl 4-[[1-(5-chloranylthiophen-2-yl)ethylamino]methyl]benzoate

Systemtic Name: methyl 4-[[1-(5-chloranylthiophen-2-yl)ethylamino]methyl]benzoate Openeye Name: methyl 4-[[1-(5-chloro-2-thienyl)ethylamino]methyl]benzoate CAS Name: 4-[[1-(5-chloro-2-thiophenyl)ethylamino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[1-(5-chlorothiophen-2-yl)ethylamino]methyl]benzoate Traditional Name: 4-[[1-(5-chloro-2-thienyl)ethylamino]methyl]benzoic acid methyl ester Formula: C15H16ClNO2S MolecularWeight: 309.81104

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(S1)Cl)NCC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CC(C1=CC=C(S1)Cl)NCC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C15H16ClNO2S/c1-10(13-7-8-14(16)20-13)17-9-11-3-5-12(6-4-11)15(18)19-2/h3-8,10,17H,9H2,1-2H3