3-heptyl-4-phenyl-1,2-oxazol-5-amine

Systemtic Name: 3-heptyl-4-phenyl-1,2-oxazol-5-amine Openeye Name: 3-heptyl-4-phenyl-isoxazol-5-amine CAS Name: 3-heptyl-4-phenyl-5-isoxazolamine IUPAC Name: 3-heptyl-4-phenyl-1,2-oxazol-5-amine Traditional Name: (3-heptyl-4-phenyl-isoxazol-5-yl)amine Formula: C16H22N2O MolecularWeight: 258.35868

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=NOC(=C1C2=CC=CC=C2)N

Isomeric SMILES

CCCCCCCC1=NOC(=C1C2=CC=CC=C2)N

InChI

InChI=1S/C16H22N2O/c1-2-3-4-5-9-12-14-15(16(17)19-18-14)13-10-7-6-8-11-13/h6-8,10-11H,2-5,9,12,17H2,1H3