(3-phenyl-1,2,4-oxadiazol-5-yl)methyl 2-[(4-butoxyphenyl)carbonylamino]ethanoate

Systemtic Name: (3-phenyl-1,2,4-oxadiazol-5-yl)methyl 2-[(4-butoxyphenyl)carbonylamino]ethanoate Openeye Name: (3-phenyl-1,2,4-oxadiazol-5-yl)methyl 2-[(4-butoxybenzoyl)amino]acetate CAS Name: 2-[[(4-butoxyphenyl)-oxomethyl]amino]acetic acid (3-phenyl-1,2,4-oxadiazol-5-yl)methyl ester IUPAC Name: (3-phenyl-1,2,4-oxadiazol-5-yl)methyl 2-[(4-butoxybenzoyl)amino]acetate Traditional Name: 2-[(4-butoxybenzoyl)amino]acetic acid (3-phenyl-1,2,4-oxadiazol-5-yl)methyl ester Formula: C22H23N3O5 MolecularWeight: 409.43512

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NCC(=O)OCC2=NC(=NO2)C3=CC=CC=C3

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NCC(=O)OCC2=NC(=NO2)C3=CC=CC=C3

InChI

InChI=1S/C22H23N3O5/c1-2-3-13-28-18-11-9-17(10-12-18)22(27)23-14-20(26)29-15-19-24-21(25-30-19)16-7-5-4-6-8-16/h4-12H,2-3,13-15H2,1H3,(H,23,27)