N-[2-(1,2-oxazol-3-ylamino)-2-oxidanylidene-ethyl]-N-[[(2R)-oxolan-2-yl]methyl]-4-pentyl-benzamide

Systemtic Name: N-[2-(1,2-oxazol-3-ylamino)-2-oxidanylidene-ethyl]-N-[[(2R)-oxolan-2-yl]methyl]-4-pentyl-benzamide Openeye Name: N-[2-(isoxazol-3-ylamino)-2-oxo-ethyl]-4-pentyl-N-[[(2R)-tetrahydrofuran-2-yl]methyl]benzamide CAS Name: N-[2-(3-isoxazolylamino)-2-oxoethyl]-N-[[(2R)-2-oxolanyl]methyl]-4-pentylbenzamide IUPAC Name: N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]-N-[[(2R)-oxolan-2-yl]methyl]-4-pentylbenzamide Traditional Name: 4-amyl-N-[2-(isoxazol-3-ylamino)-2-keto-ethyl]-N-[[(2R)-tetrahydrofuran-2-yl]methyl]benzamide Formula: C22H29N3O4 MolecularWeight: 399.48336

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C(=O)N(CC2CCCO2)CC(=O)NC3=NOC=C3

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C(=O)N(C[C@H]2CCCO2)CC(=O)NC3=NOC=C3

InChI

InChI=1S/C22H29N3O4/c1-2-3-4-6-17-8-10-18(11-9-17)22(27)25(15-19-7-5-13-28-19)16-21(26)23-20-12-14-29-24-20/h8-12,14,19H,2-7,13,15-16H2,1H3,(H,23,24,26)/t19-/m1/s1