4-[(4-methoxyphenyl)methyl]-5-nitro-3-piperidin-4-yl-1-benzofuran-2-carboxamide

Systemtic Name: 4-[(4-methoxyphenyl)methyl]-5-nitro-3-piperidin-4-yl-1-benzofuran-2-carboxamide Openeye Name: 4-[(4-methoxyphenyl)methyl]-5-nitro-3-(4-piperidyl)benzofuran-2-carboxamide CAS Name: 4-[(4-methoxyphenyl)methyl]-5-nitro-3-(4-piperidinyl)-2-benzofurancarboxamide IUPAC Name: 4-[(4-methoxyphenyl)methyl]-5-nitro-3-piperidin-4-yl-1-benzofuran-2-carboxamide Traditional Name: 5-nitro-4-p-anisyl-3-(4-piperidyl)coumarilamide Formula: C22H23N3O5 MolecularWeight: 409.43512

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC2=C(C=CC3=C2C(=C(O3)C(=O)N)C4CCNCC4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)CC2=C(C=CC3=C2C(=C(O3)C(=O)N)C4CCNCC4)[N+](=O)[O-]

InChI

InChI=1S/C22H23N3O5/c1-29-15-4-2-13(3-5-15)12-16-17(25(27)28)6-7-18-20(16)19(21(30-18)22(23)26)14-8-10-24-11-9-14/h2-7,14,24H,8-12H2,1H3,(H2,23,26)