2-[1-azanyl-2-(4-hydroxyphenyl)ethyl]-N-(2-oxidanylideneazepan-3-yl)-1,3-oxazole-4-carboxamide

Systemtic Name: 2-[1-azanyl-2-(4-hydroxyphenyl)ethyl]-N-(2-oxidanylideneazepan-3-yl)-1,3-oxazole-4-carboxamide Openeye Name: 2-[1-amino-2-(4-hydroxyphenyl)ethyl]-N-(2-oxoazepan-3-yl)oxazole-4-carboxamide CAS Name: 2-[1-amino-2-(4-hydroxyphenyl)ethyl]-N-(2-oxo-3-azepanyl)-4-oxazolecarboxamide IUPAC Name: 2-[1-amino-2-(4-hydroxyphenyl)ethyl]-N-(2-oxoazepan-3-yl)-1,3-oxazole-4-carboxamide Traditional Name: 2-[1-amino-2-(4-hydroxyphenyl)ethyl]-N-(2-ketoazepan-3-yl)oxazole-4-carboxamide Formula: C18H22N4O4 MolecularWeight: 358.39168

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)NC(=O)C2=COC(=N2)C(CC3=CC=C(C=C3)O)N

Isomeric SMILES

C1CCNC(=O)C(C1)NC(=O)C2=COC(=N2)C(CC3=CC=C(C=C3)O)N

InChI

InChI=1S/C18H22N4O4/c19-13(9-11-4-6-12(23)7-5-11)18-22-15(10-26-18)17(25)21-14-3-1-2-8-20-16(14)24/h4-7,10,13-14,23H,1-3,8-9,19H2,(H,20,24)(H,21,25)