1-[2-[(3-ethynylphenyl)amino]-2-oxidanylidene-ethyl]cyclopentane-1-carboxylic acid

Systemtic Name: 1-[2-[(3-ethynylphenyl)amino]-2-oxidanylidene-ethyl]cyclopentane-1-carboxylic acid Openeye Name: 1-[2-(3-ethynylanilino)-2-oxo-ethyl]cyclopentanecarboxylic acid CAS Name: 1-[2-(3-ethynylanilino)-2-oxoethyl]-1-cyclopentanecarboxylic acid IUPAC Name: 1-[2-(3-ethynylanilino)-2-oxoethyl]cyclopentane-1-carboxylic acid Traditional Name: 1-[2-(3-ethynylanilino)-2-keto-ethyl]cyclopentanecarboxylic acid Formula: C16H17NO3 MolecularWeight: 271.31108

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC(=CC=C1)NC(=O)CC2(CCCC2)C(=O)O

Isomeric SMILES

C#CC1=CC(=CC=C1)NC(=O)CC2(CCCC2)C(=O)O

InChI

InChI=1S/C16H17NO3/c1-2-12-6-5-7-13(10-12)17-14(18)11-16(15(19)20)8-3-4-9-16/h1,5-7,10H,3-4,8-9,11H2,(H,17,18)(H,19,20)