cyclopentyl 2-[2-[1-oxidanyl-2-(oxidanylamino)-2-oxidanylidene-ethyl]pent-4-ynoylamino]-3-phenyl-propanoate

Systemtic Name: cyclopentyl 2-[2-[1-oxidanyl-2-(oxidanylamino)-2-oxidanylidene-ethyl]pent-4-ynoylamino]-3-phenyl-propanoate Openeye Name: cyclopentyl 2-[2-[1-hydroxy-2-(hydroxyamino)-2-oxo-ethyl]pent-4-ynoylamino]-3-phenyl-propanoate CAS Name: 2-[[2-[1-hydroxy-2-(hydroxyamino)-2-oxoethyl]-1-oxopent-4-ynyl]amino]-3-phenylpropanoic acid cyclopentyl ester IUPAC Name: cyclopentyl 2-[2-[1-hydroxy-2-(hydroxyamino)-2-oxoethyl]pent-4-ynoylamino]-3-phenylpropanoate Traditional Name: 2-[2-[1-hydroxy-2-(hydroxyamino)-2-keto-ethyl]pent-4-ynoylamino]-3-phenyl-propionic acid cyclopentyl ester Formula: C21H26N2O6 MolecularWeight: 402.44094

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Descriptors Computed from Structure

Canonical SMILES:

C#CCC(C(C(=O)NO)O)C(=O)NC(CC1=CC=CC=C1)C(=O)OC2CCCC2

Isomeric SMILES

C#CCC(C(C(=O)NO)O)C(=O)NC(CC1=CC=CC=C1)C(=O)OC2CCCC2

InChI

InChI=1S/C21H26N2O6/c1-2-8-16(18(24)20(26)23-28)19(25)22-17(13-14-9-4-3-5-10-14)21(27)29-15-11-6-7-12-15/h1,3-5,9-10,15-18,24,28H,6-8,11-13H2,(H,22,25)(H,23,26)