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

Systemtic Name: 4-[5-(2-oxidanylideneethyl)-4,5-dihydro-1,2-oxazol-3-yl]-N'-propyl-benzenecarboximidamide Openeye Name: 4-[5-(2-oxoethyl)-4,5-dihydroisoxazol-3-yl]-N'-propyl-benzamidine CAS Name: 4-[5-(2-oxoethyl)-4,5-dihydroisoxazol-3-yl]-N'-propylbenzenecarboximidamide IUPAC Name: 4-[5-(2-oxoethyl)-4,5-dihydro-1,2-oxazol-3-yl]-N'-propylbenzenecarboximidamide Traditional Name: 4-[5-(2-ketoethyl)-2-isoxazolin-3-yl]-N'-propyl-benzamidine Formula: C15H19N3O2 MolecularWeight: 273.33026

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19N3O2/c1-2-8-17-15(16)12-5-3-11(4-6-12)14-10-13(7-9-19)20-18-14/h3-6,9,13H,2,7-8,10H2,1H3,(H2,16,17)