N-(2-azanyl-3-phenyl-propanoyl)-N-[(3-bromanyl-4,5-dihydro-1,2-oxazol-5-yl)methyl]benzamide

Systemtic Name: N-(2-azanyl-3-phenyl-propanoyl)-N-[(3-bromanyl-4,5-dihydro-1,2-oxazol-5-yl)methyl]benzamide Openeye Name: N-(2-amino-3-phenyl-propanoyl)-N-[(3-bromo-4,5-dihydroisoxazol-5-yl)methyl]benzamide CAS Name: N-(2-amino-1-oxo-3-phenylpropyl)-N-[(3-bromo-4,5-dihydroisoxazol-5-yl)methyl]benzamide IUPAC Name: N-(2-amino-3-phenylpropanoyl)-N-[(3-bromo-4,5-dihydro-1,2-oxazol-5-yl)methyl]benzamide Traditional Name: N-[(3-bromo-2-isoxazolin-5-yl)methyl]-N-phenylalanyl-benzamide Formula: C20H20BrN3O3 MolecularWeight: 430.2951

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Descriptors Computed from Structure

Canonical SMILES:

C1C(ON=C1Br)CN(C(=O)C2=CC=CC=C2)C(=O)C(CC3=CC=CC=C3)N

Isomeric SMILES

C1C(ON=C1Br)CN(C(=O)C2=CC=CC=C2)C(=O)C(CC3=CC=CC=C3)N

InChI

InChI=1S/C20H20BrN3O3/c21-18-12-16(27-23-18)13-24(19(25)15-9-5-2-6-10-15)20(26)17(22)11-14-7-3-1-4-8-14/h1-10,16-17H,11-13,22H2