2-[cyclopentyl(2-methylpropanoyl)amino]ethanoic acid; 2,2-dimethyl-1-thiophen-3-yl-propan-1-one

Systemtic Name: 2-[cyclopentyl(2-methylpropanoyl)amino]ethanoic acid; 2,2-dimethyl-1-thiophen-3-yl-propan-1-one Openeye Name: 2-[cyclopentyl(2-methylpropanoyl)amino]acetic acid; 2,2-dimethyl-1-(3-thienyl)propan-1-one CAS Name: 2-[cyclopentyl-(2-methyl-1-oxopropyl)amino]acetic acid; 2,2-dimethyl-1-(3-thiophenyl)-1-propanone IUPAC Name: 2-[cyclopentyl(2-methylpropanoyl)amino]acetic acid; 2,2-dimethyl-1-thiophen-3-ylpropan-1-one Traditional Name: 2-[cyclopentyl(isobutyryl)amino]acetic acid; 2,2-dimethyl-1-(3-thienyl)propan-1-one Formula: C20H31NO4S MolecularWeight: 381.52944

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N(CC(=O)O)C1CCCC1.CC(C)(C)C(=O)C1=CSC=C1

Isomeric SMILES

CC(C)C(=O)N(CC(=O)O)C1CCCC1.CC(C)(C)C(=O)C1=CSC=C1

InChI

InChI=1S/C11H19NO3.C9H12OS/c1-8(2)11(15)12(7-10(13)14)9-5-3-4-6-9;1-9(2,3)8(10)7-4-5-11-6-7/h8-9H,3-7H2,1-2H3,(H,13,14);4-6H,1-3H3