N-[2-[4-[(2-methoxyphenyl)methyl]piperazin-1-yl]carbonyl-1-benzofuran-3-yl]-3-methyl-butanamide

Systemtic Name: N-[2-[4-[(2-methoxyphenyl)methyl]piperazin-1-yl]carbonyl-1-benzofuran-3-yl]-3-methyl-butanamide Openeye Name: N-[2-[4-[(2-methoxyphenyl)methyl]piperazine-1-carbonyl]benzofuran-3-yl]-3-methyl-butanamide CAS Name: N-[2-[[4-[(2-methoxyphenyl)methyl]-1-piperazinyl]-oxomethyl]-3-benzofuranyl]-3-methylbutanamide IUPAC Name: N-[2-[4-[(2-methoxyphenyl)methyl]piperazine-1-carbonyl]-1-benzofuran-3-yl]-3-methylbutanamide Traditional Name: 3-methyl-N-[2-(4-o-anisylpiperazine-1-carbonyl)benzofuran-3-yl]butyramide Formula: C26H31N3O4 MolecularWeight: 449.54204

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=C(OC2=CC=CC=C21)C(=O)N3CCN(CC3)CC4=CC=CC=C4OC

Isomeric SMILES

CC(C)CC(=O)NC1=C(OC2=CC=CC=C21)C(=O)N3CCN(CC3)CC4=CC=CC=C4OC

InChI

InChI=1S/C26H31N3O4/c1-18(2)16-23(30)27-24-20-9-5-7-11-22(20)33-25(24)26(31)29-14-12-28(13-15-29)17-19-8-4-6-10-21(19)32-3/h4-11,18H,12-17H2,1-3H3,(H,27,30)