4-(3-chlorophenyl)-3-heptyl-1,2-oxazol-5-amine

Systemtic Name: 4-(3-chlorophenyl)-3-heptyl-1,2-oxazol-5-amine Openeye Name: 4-(3-chlorophenyl)-3-heptyl-isoxazol-5-amine CAS Name: 4-(3-chlorophenyl)-3-heptyl-5-isoxazolamine IUPAC Name: 4-(3-chlorophenyl)-3-heptyl-1,2-oxazol-5-amine Traditional Name: [4-(3-chlorophenyl)-3-heptyl-isoxazol-5-yl]amine Formula: C16H21ClN2O MolecularWeight: 292.80374

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21ClN2O/c1-2-3-4-5-6-10-14-15(16(18)20-19-14)12-8-7-9-13(17)11-12/h7-9,11H,2-6,10,18H2,1H3