N'-(3-methylbutyl)-4-[5-(2-oxidanylideneethyl)-4,5-dihydro-1,2-oxazol-3-yl]benzenecarboximidamide

Systemtic Name: N'-(3-methylbutyl)-4-[5-(2-oxidanylideneethyl)-4,5-dihydro-1,2-oxazol-3-yl]benzenecarboximidamide Openeye Name: N'-isopentyl-4-[5-(2-oxoethyl)-4,5-dihydroisoxazol-3-yl]benzamidine CAS Name: N'-(3-methylbutyl)-4-[5-(2-oxoethyl)-4,5-dihydroisoxazol-3-yl]benzenecarboximidamide IUPAC Name: N'-(3-methylbutyl)-4-[5-(2-oxoethyl)-4,5-dihydro-1,2-oxazol-3-yl]benzenecarboximidamide Traditional Name: N'-isoamyl-4-[5-(2-ketoethyl)-2-isoxazolin-3-yl]benzamidine Formula: C17H23N3O2 MolecularWeight: 301.38342

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN=C(C1=CC=C(C=C1)C2=NOC(C2)CC=O)N

Isomeric SMILES

CC(C)CCN=C(C1=CC=C(C=C1)C2=NOC(C2)CC=O)N

InChI

InChI=1S/C17H23N3O2/c1-12(2)7-9-19-17(18)14-5-3-13(4-6-14)16-11-15(8-10-21)22-20-16/h3-6,10,12,15H,7-9,11H2,1-2H3,(H2,18,19)