[5-bromanyl-6-(1,2,3,4-tetrazol-1-ylmethoxy)naphthalen-2-yl]-(2-butyl-1-benzofuran-3-yl)methanone

Systemtic Name: [5-bromanyl-6-(1,2,3,4-tetrazol-1-ylmethoxy)naphthalen-2-yl]-(2-butyl-1-benzofuran-3-yl)methanone Openeye Name: [5-bromo-6-(tetrazol-1-ylmethoxy)-2-naphthyl]-(2-butylbenzofuran-3-yl)methanone CAS Name: [5-bromo-6-(1-tetrazolylmethoxy)-2-naphthalenyl]-(2-butyl-3-benzofuranyl)methanone IUPAC Name: [5-bromo-6-(tetrazol-1-ylmethoxy)naphthalen-2-yl]-(2-butyl-1-benzofuran-3-yl)methanone Traditional Name: [5-bromo-6-(tetrazol-1-ylmethoxy)-2-naphthyl]-(2-butylbenzofuran-3-yl)methanone Formula: C25H21BrN4O3 MolecularWeight: 505.36324

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C2=CC=CC=C2O1)C(=O)C3=CC4=C(C=C3)C(=C(C=C4)OCN5C=NN=N5)Br

Isomeric SMILES

CCCCC1=C(C2=CC=CC=C2O1)C(=O)C3=CC4=C(C=C3)C(=C(C=C4)OCN5C=NN=N5)Br

InChI

InChI=1S/C25H21BrN4O3/c1-2-3-7-21-23(19-6-4-5-8-20(19)33-21)25(31)17-9-11-18-16(13-17)10-12-22(24(18)26)32-15-30-14-27-28-29-30/h4-6,8-14H,2-3,7,15H2,1H3