[2-[2-(2H-1,2,3,4-tetrazol-5-yl)phenyl]-1-benzofuran-5-yl]methyl 3-methyl-2-[pentanoyl-(phenylmethyl)amino]butanoate

Systemtic Name: [2-[2-(2H-1,2,3,4-tetrazol-5-yl)phenyl]-1-benzofuran-5-yl]methyl 3-methyl-2-[pentanoyl-(phenylmethyl)amino]butanoate Openeye Name: [2-[2-(2H-tetrazol-5-yl)phenyl]benzofuran-5-yl]methyl 2-[benzyl(pentanoyl)amino]-3-methyl-butanoate CAS Name: 3-methyl-2-[1-oxopentyl-(phenylmethyl)amino]butanoic acid [2-[2-(2H-tetrazol-5-yl)phenyl]-5-benzofuranyl]methyl ester IUPAC Name: [2-[2-(2H-tetrazol-5-yl)phenyl]-1-benzofuran-5-yl]methyl 2-[benzyl(pentanoyl)amino]-3-methylbutanoate Traditional Name: 2-[benzyl(valeryl)amino]-3-methyl-butyric acid [2-[2-(2H-tetrazol-5-yl)phenyl]benzofuran-5-yl]methyl ester Formula: C33H35N5O4 MolecularWeight: 565.6621

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)N(CC1=CC=CC=C1)C(C(C)C)C(=O)OCC2=CC3=C(C=C2)OC(=C3)C4=CC=CC=C4C5=NNN=N5

Isomeric SMILES

CCCCC(=O)N(CC1=CC=CC=C1)C(C(C)C)C(=O)OCC2=CC3=C(C=C2)OC(=C3)C4=CC=CC=C4C5=NNN=N5

InChI

InChI=1S/C33H35N5O4/c1-4-5-15-30(39)38(20-23-11-7-6-8-12-23)31(22(2)3)33(40)41-21-24-16-17-28-25(18-24)19-29(42-28)26-13-9-10-14-27(26)32-34-36-37-35-32/h6-14,16-19,22,31H,4-5,15,20-21H2,1-3H3,(H,34,35,36,37)