1-(2-phenethylsulfanylethanoylamino)cyclopentane-1-carboxylic acid

Systemtic Name: 1-(2-phenethylsulfanylethanoylamino)cyclopentane-1-carboxylic acid Openeye Name: 1-[(2-phenethylsulfanylacetyl)amino]cyclopentanecarboxylic acid CAS Name: 1-[[1-oxo-2-(phenethylthio)ethyl]amino]-1-cyclopentanecarboxylic acid IUPAC Name: 1-[(2-phenethylsulfanylacetyl)amino]cyclopentane-1-carboxylic acid Traditional Name: 1-[[2-(phenethylthio)acetyl]amino]cyclopentanecarboxylic acid Formula: C16H21NO3S MolecularWeight: 307.40784

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(C(=O)O)NC(=O)CSCCC2=CC=CC=C2

Isomeric SMILES

C1CCC(C1)(C(=O)O)NC(=O)CSCCC2=CC=CC=C2

InChI

InChI=1S/C16H21NO3S/c18-14(17-16(15(19)20)9-4-5-10-16)12-21-11-8-13-6-2-1-3-7-13/h1-3,6-7H,4-5,8-12H2,(H,17,18)(H,19,20)