[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]-[5-methoxy-4-(2-methoxyethoxy)-2-nitro-phenyl]methanone

Systemtic Name: [4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]-[5-methoxy-4-(2-methoxyethoxy)-2-nitro-phenyl]methanone Openeye Name: [4-(2,3-dihydrobenzofuran-5-ylmethyl)piperazin-1-yl]-[5-methoxy-4-(2-methoxyethoxy)-2-nitro-phenyl]methanone CAS Name: [4-(2,3-dihydrobenzofuran-5-ylmethyl)-1-piperazinyl]-[5-methoxy-4-(2-methoxyethoxy)-2-nitrophenyl]methanone IUPAC Name: [4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]-[5-methoxy-4-(2-methoxyethoxy)-2-nitrophenyl]methanone Traditional Name: [4-(coumaran-5-ylmethyl)piperazino]-[5-methoxy-4-(2-methoxyethoxy)-2-nitro-phenyl]methanone Formula: C24H29N3O7 MolecularWeight: 471.50296

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=C(C=C(C(=C1)[N+](=O)[O-])C(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCC4)OC

Isomeric SMILES

COCCOC1=C(C=C(C(=C1)[N+](=O)[O-])C(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCC4)OC

InChI

InChI=1S/C24H29N3O7/c1-31-11-12-34-23-15-20(27(29)30)19(14-22(23)32-2)24(28)26-8-6-25(7-9-26)16-17-3-4-21-18(13-17)5-10-33-21/h3-4,13-15H,5-12,16H2,1-2H3