4-[3-[4-(2-azanyl-2-oxidanylidene-ethyl)-2-ethanoyl-phenoxy]-2-oxidanyl-propyl]piperazine-1-carboxamide

Systemtic Name: 4-[3-[4-(2-azanyl-2-oxidanylidene-ethyl)-2-ethanoyl-phenoxy]-2-oxidanyl-propyl]piperazine-1-carboxamide Openeye Name: 4-[3-[2-acetyl-4-(2-amino-2-oxo-ethyl)phenoxy]-2-hydroxy-propyl]piperazine-1-carboxamide CAS Name: 4-[3-[2-acetyl-4-(2-amino-2-oxoethyl)phenoxy]-2-hydroxypropyl]-1-piperazinecarboxamide IUPAC Name: 4-[3-[2-acetyl-4-(2-amino-2-oxoethyl)phenoxy]-2-hydroxypropyl]piperazine-1-carboxamide Traditional Name: 4-[3-[2-acetyl-4-(2-amino-2-keto-ethyl)phenoxy]-2-hydroxy-propyl]piperazine-1-carboxamide Formula: C18H26N4O5 MolecularWeight: 378.42284

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C=CC(=C1)CC(=O)N)OCC(CN2CCN(CC2)C(=O)N)O

Isomeric SMILES

CC(=O)C1=C(C=CC(=C1)CC(=O)N)OCC(CN2CCN(CC2)C(=O)N)O

InChI

InChI=1S/C18H26N4O5/c1-12(23)15-8-13(9-17(19)25)2-3-16(15)27-11-14(24)10-21-4-6-22(7-5-21)18(20)26/h2-3,8,14,24H,4-7,9-11H2,1H3,(H2,19,25)(H2,20,26)