5-[(3-ethynylphenyl)carbamoylamino]-5-oxidanylidene-pentanoate

Systemtic Name: 5-[(3-ethynylphenyl)carbamoylamino]-5-oxidanylidene-pentanoate Openeye Name: 5-[(3-ethynylphenyl)carbamoylamino]-5-oxo-pentanoate CAS Name: 5-[[(3-ethynylanilino)-oxomethyl]amino]-5-oxopentanoate IUPAC Name: 5-[(3-ethynylphenyl)carbamoylamino]-5-oxopentanoate Traditional Name: 5-[(3-ethynylphenyl)carbamoylamino]-5-keto-valerate Formula: C14H13N2O4- MolecularWeight: 273.26402

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC(=CC=C1)NC(=O)NC(=O)CCCC(=O)[O-]

Isomeric SMILES

C#CC1=CC(=CC=C1)NC(=O)NC(=O)CCCC(=O)[O-]

InChI

InChI=1S/C14H14N2O4/c1-2-10-5-3-6-11(9-10)15-14(20)16-12(17)7-4-8-13(18)19/h1,3,5-6,9H,4,7-8H2,(H,18,19)(H2,15,16,17,20)/p-1