5-[2-(3-methylbutyl)pyrrolidin-1-yl]carbonylthiophene-2-carboxylic acid

Systemtic Name: 5-[2-(3-methylbutyl)pyrrolidin-1-yl]carbonylthiophene-2-carboxylic acid Openeye Name: 5-(2-isopentylpyrrolidine-1-carbonyl)thiophene-2-carboxylic acid CAS Name: 5-[[2-(3-methylbutyl)-1-pyrrolidinyl]-oxomethyl]-2-thiophenecarboxylic acid IUPAC Name: 5-[2-(3-methylbutyl)pyrrolidine-1-carbonyl]thiophene-2-carboxylic acid Traditional Name: 5-(2-isoamylpyrrolidine-1-carbonyl)-2-thenoic acid Formula: C15H21NO3S MolecularWeight: 295.39714

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC1CCCN1C(=O)C2=CC=C(S2)C(=O)O

Isomeric SMILES

CC(C)CCC1CCCN1C(=O)C2=CC=C(S2)C(=O)O

InChI

InChI=1S/C15H21NO3S/c1-10(2)5-6-11-4-3-9-16(11)14(17)12-7-8-13(20-12)15(18)19/h7-8,10-11H,3-6,9H2,1-2H3,(H,18,19)