2-[2-[2-[bis(oxidanyl)amino]-2-oxidanylidene-ethyl]pent-4-ynoylamino]-3-phenyl-propanoic acid

Systemtic Name: 2-[2-[2-[bis(oxidanyl)amino]-2-oxidanylidene-ethyl]pent-4-ynoylamino]-3-phenyl-propanoic acid Openeye Name: 2-[2-[2-(dihydroxyamino)-2-oxo-ethyl]pent-4-ynoylamino]-3-phenyl-propanoic acid CAS Name: 2-[[2-[2-(dihydroxyamino)-2-oxoethyl]-1-oxopent-4-ynyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[2-[2-(dihydroxyamino)-2-oxoethyl]pent-4-ynoylamino]-3-phenylpropanoic acid Traditional Name: 2-[2-[2-(dihydroxyamino)-2-keto-ethyl]pent-4-ynoylamino]-3-phenyl-propionic acid Formula: C16H18N2O6 MolecularWeight: 334.32392

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Descriptors Computed from Structure

Canonical SMILES:

C#CCC(CC(=O)N(O)O)C(=O)NC(CC1=CC=CC=C1)C(=O)O

Isomeric SMILES

C#CCC(CC(=O)N(O)O)C(=O)NC(CC1=CC=CC=C1)C(=O)O

InChI

InChI=1S/C16H18N2O6/c1-2-6-12(10-14(19)18(23)24)15(20)17-13(16(21)22)9-11-7-4-3-5-8-11/h1,3-5,7-8,12-13,23-24H,6,9-10H2,(H,17,20)(H,21,22)