methyl 4-[[(2-methyl-1-thiophen-2-yl-propyl)amino]methyl]benzoate

Systemtic Name: methyl 4-[[(2-methyl-1-thiophen-2-yl-propyl)amino]methyl]benzoate Openeye Name: methyl 4-[[[2-methyl-1-(2-thienyl)propyl]amino]methyl]benzoate CAS Name: 4-[[(2-methyl-1-thiophen-2-ylpropyl)amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[(2-methyl-1-thiophen-2-ylpropyl)amino]methyl]benzoate Traditional Name: 4-[[[2-methyl-1-(2-thienyl)propyl]amino]methyl]benzoic acid methyl ester Formula: C17H21NO2S MolecularWeight: 303.41914

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC=CS1)NCC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CC(C)C(C1=CC=CS1)NCC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C17H21NO2S/c1-12(2)16(15-5-4-10-21-15)18-11-13-6-8-14(9-7-13)17(19)20-3/h4-10,12,16,18H,11H2,1-3H3