[3-(4-bromophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl naphthalene-2-carboxylate

Systemtic Name: [3-(4-bromophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl naphthalene-2-carboxylate Openeye Name: [3-(4-bromophenyl)-4,5-dihydroisoxazol-5-yl]methyl naphthalene-2-carboxylate CAS Name: 2-naphthalenecarboxylic acid [3-(4-bromophenyl)-4,5-dihydroisoxazol-5-yl]methyl ester IUPAC Name: [3-(4-bromophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl naphthalene-2-carboxylate Traditional Name: naphthalene-2-carboxylic acid [3-(4-bromophenyl)-2-isoxazolin-5-yl]methyl ester Formula: C21H16BrNO3 MolecularWeight: 410.26064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(ON=C1C2=CC=C(C=C2)Br)COC(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1C(ON=C1C2=CC=C(C=C2)Br)COC(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C21H16BrNO3/c22-18-9-7-15(8-10-18)20-12-19(26-23-20)13-25-21(24)17-6-5-14-3-1-2-4-16(14)11-17/h1-11,19H,12-13H2