4-[(3-ethynylphenyl)carbamoyl-methyl-amino]butanoic acid

Systemtic Name: 4-[(3-ethynylphenyl)carbamoyl-methyl-amino]butanoic acid Openeye Name: 4-[(3-ethynylphenyl)carbamoyl-methyl-amino]butanoic acid CAS Name: 4-[[(3-ethynylanilino)-oxomethyl]-methylamino]butanoic acid IUPAC Name: 4-[(3-ethynylphenyl)carbamoyl-methylamino]butanoic acid Traditional Name: 4-[(3-ethynylphenyl)carbamoyl-methyl-amino]butyric acid Formula: C14H16N2O3 MolecularWeight: 260.28844

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC(=O)O)C(=O)NC1=CC=CC(=C1)C#C

Isomeric SMILES

CN(CCCC(=O)O)C(=O)NC1=CC=CC(=C1)C#C

InChI

InChI=1S/C14H16N2O3/c1-3-11-6-4-7-12(10-11)15-14(19)16(2)9-5-8-13(17)18/h1,4,6-7,10H,5,8-9H2,2H3,(H,15,19)(H,17,18)