methyl 3-[1-(3-bromophenyl)ethylamino]-3-thiophen-2-yl-propanoate

Systemtic Name: methyl 3-[1-(3-bromophenyl)ethylamino]-3-thiophen-2-yl-propanoate Openeye Name: methyl 3-[1-(3-bromophenyl)ethylamino]-3-(2-thienyl)propanoate CAS Name: 3-[1-(3-bromophenyl)ethylamino]-3-thiophen-2-ylpropanoic acid methyl ester IUPAC Name: methyl 3-[1-(3-bromophenyl)ethylamino]-3-thiophen-2-ylpropanoate Traditional Name: 3-[1-(3-bromophenyl)ethylamino]-3-(2-thienyl)propionic acid methyl ester Formula: C16H18BrNO2S MolecularWeight: 368.28862

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)Br)NC(CC(=O)OC)C2=CC=CS2

Isomeric SMILES

CC(C1=CC(=CC=C1)Br)NC(CC(=O)OC)C2=CC=CS2

InChI

InChI=1S/C16H18BrNO2S/c1-11(12-5-3-6-13(17)9-12)18-14(10-16(19)20-2)15-7-4-8-21-15/h3-9,11,14,18H,10H2,1-2H3