methyl 3-methyl-2-[(5-methylthiophen-2-yl)methylamino]pentanoate

Systemtic Name: methyl 3-methyl-2-[(5-methylthiophen-2-yl)methylamino]pentanoate Openeye Name: methyl 3-methyl-2-[(5-methyl-2-thienyl)methylamino]pentanoate CAS Name: 3-methyl-2-[(5-methyl-2-thiophenyl)methylamino]pentanoic acid methyl ester IUPAC Name: methyl 3-methyl-2-[(5-methylthiophen-2-yl)methylamino]pentanoate Traditional Name: 3-methyl-2-[(5-methyl-2-thienyl)methylamino]valeric acid methyl ester Formula: C13H21NO2S MolecularWeight: 255.37634

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OC)NCC1=CC=C(S1)C

Isomeric SMILES

CCC(C)C(C(=O)OC)NCC1=CC=C(S1)C

InChI

InChI=1S/C13H21NO2S/c1-5-9(2)12(13(15)16-4)14-8-11-7-6-10(3)17-11/h6-7,9,12,14H,5,8H2,1-4H3