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

Systemtic Name: N'-(2-methylpropyl)-4-[5-(2-oxidanylideneethyl)-4,5-dihydro-1,2-oxazol-3-yl]benzenecarboximidamide Openeye Name: N'-isobutyl-4-[5-(2-oxoethyl)-4,5-dihydroisoxazol-3-yl]benzamidine CAS Name: N'-(2-methylpropyl)-4-[5-(2-oxoethyl)-4,5-dihydroisoxazol-3-yl]benzenecarboximidamide IUPAC Name: N'-(2-methylpropyl)-4-[5-(2-oxoethyl)-4,5-dihydro-1,2-oxazol-3-yl]benzenecarboximidamide Traditional Name: N'-isobutyl-4-[5-(2-ketoethyl)-2-isoxazolin-3-yl]benzamidine Formula: C16H21N3O2 MolecularWeight: 287.35684

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21N3O2/c1-11(2)10-18-16(17)13-5-3-12(4-6-13)15-9-14(7-8-20)21-19-15/h3-6,8,11,14H,7,9-10H2,1-2H3,(H2,17,18)