2-[3-(aminomethyl)phenyl]-N-(1-oxidanyl-2-oxidanylidene-5-phenyl-pentan-3-yl)-1,3-oxazole-4-carboxamide

Systemtic Name: 2-[3-(aminomethyl)phenyl]-N-(1-oxidanyl-2-oxidanylidene-5-phenyl-pentan-3-yl)-1,3-oxazole-4-carboxamide Openeye Name: 2-[3-(aminomethyl)phenyl]-N-(3-hydroxy-2-oxo-1-phenethyl-propyl)oxazole-4-carboxamide CAS Name: 2-[3-(aminomethyl)phenyl]-N-(1-hydroxy-2-oxo-5-phenylpentan-3-yl)-4-oxazolecarboxamide IUPAC Name: 2-[3-(aminomethyl)phenyl]-N-(1-hydroxy-2-oxo-5-phenylpentan-3-yl)-1,3-oxazole-4-carboxamide Traditional Name: 2-[3-(aminomethyl)phenyl]-N-(3-hydroxy-2-keto-1-phenethyl-propyl)oxazole-4-carboxamide Formula: C22H23N3O4 MolecularWeight: 393.43572

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(C(=O)CO)NC(=O)C2=COC(=N2)C3=CC(=CC=C3)CN

Isomeric SMILES

C1=CC=C(C=C1)CCC(C(=O)CO)NC(=O)C2=COC(=N2)C3=CC(=CC=C3)CN

InChI

InChI=1S/C22H23N3O4/c23-12-16-7-4-8-17(11-16)22-25-19(14-29-22)21(28)24-18(20(27)13-26)10-9-15-5-2-1-3-6-15/h1-8,11,14,18,26H,9-10,12-13,23H2,(H,24,28)