azepan-1-yl-[5-(4-bromophenyl)-1,2-oxazol-3-yl]methanone

Systemtic Name: azepan-1-yl-[5-(4-bromophenyl)-1,2-oxazol-3-yl]methanone Openeye Name: azepan-1-yl-[5-(4-bromophenyl)isoxazol-3-yl]methanone CAS Name: 1-azepanyl-[5-(4-bromophenyl)-3-isoxazolyl]methanone IUPAC Name: azepan-1-yl-[5-(4-bromophenyl)-1,2-oxazol-3-yl]methanone Traditional Name: azepan-1-yl-[5-(4-bromophenyl)isoxazol-3-yl]methanone Formula: C16H17BrN2O2 MolecularWeight: 349.22238

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2=NOC(=C2)C3=CC=C(C=C3)Br

Isomeric SMILES

C1CCCN(CC1)C(=O)C2=NOC(=C2)C3=CC=C(C=C3)Br

InChI

InChI=1S/C16H17BrN2O2/c17-13-7-5-12(6-8-13)15-11-14(18-21-15)16(20)19-9-3-1-2-4-10-19/h5-8,11H,1-4,9-10H2