(4-bromophenyl)-[2-[5-(3-methoxyphenyl)-1,3-benzoxazol-2-yl]pyrrolidin-1-yl]methanone

Systemtic Name: (4-bromophenyl)-[2-[5-(3-methoxyphenyl)-1,3-benzoxazol-2-yl]pyrrolidin-1-yl]methanone Openeye Name: (4-bromophenyl)-[2-[5-(3-methoxyphenyl)-1,3-benzoxazol-2-yl]pyrrolidin-1-yl]methanone CAS Name: (4-bromophenyl)-[2-[5-(3-methoxyphenyl)-1,3-benzoxazol-2-yl]-1-pyrrolidinyl]methanone IUPAC Name: (4-bromophenyl)-[2-[5-(3-methoxyphenyl)-1,3-benzoxazol-2-yl]pyrrolidin-1-yl]methanone Traditional Name: (4-bromophenyl)-[2-[5-(3-methoxyphenyl)-1,3-benzoxazol-2-yl]pyrrolidino]methanone Formula: C25H21BrN2O3 MolecularWeight: 477.34984

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=CC3=C(C=C2)OC(=N3)C4CCCN4C(=O)C5=CC=C(C=C5)Br

Isomeric SMILES

COC1=CC=CC(=C1)C2=CC3=C(C=C2)OC(=N3)C4CCCN4C(=O)C5=CC=C(C=C5)Br

InChI

InChI=1S/C25H21BrN2O3/c1-30-20-5-2-4-17(14-20)18-9-12-23-21(15-18)27-24(31-23)22-6-3-13-28(22)25(29)16-7-10-19(26)11-8-16/h2,4-5,7-12,14-15,22H,3,6,13H2,1H3