N-[4-[4-(1-benzofuran-2-ylcarbonyl)piperazin-1-yl]phenyl]-2-(4-methylpiperidin-1-yl)-5-nitro-benzamide

Systemtic Name: N-[4-[4-(1-benzofuran-2-ylcarbonyl)piperazin-1-yl]phenyl]-2-(4-methylpiperidin-1-yl)-5-nitro-benzamide Openeye Name: N-[4-[4-(benzofuran-2-carbonyl)piperazin-1-yl]phenyl]-2-(4-methyl-1-piperidyl)-5-nitro-benzamide CAS Name: N-[4-[4-[2-benzofuranyl(oxo)methyl]-1-piperazinyl]phenyl]-2-(4-methyl-1-piperidinyl)-5-nitrobenzamide IUPAC Name: N-[4-[4-(1-benzofuran-2-carbonyl)piperazin-1-yl]phenyl]-2-(4-methylpiperidin-1-yl)-5-nitrobenzamide Traditional Name: N-[4-[4-(benzofuran-2-carbonyl)piperazino]phenyl]-2-(4-methylpiperidino)-5-nitro-benzamide Formula: C32H33N5O5 MolecularWeight: 567.63492

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NC3=CC=C(C=C3)N4CCN(CC4)C(=O)C5=CC6=CC=CC=C6O5

Isomeric SMILES

CC1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NC3=CC=C(C=C3)N4CCN(CC4)C(=O)C5=CC6=CC=CC=C6O5

InChI

InChI=1S/C32H33N5O5/c1-22-12-14-35(15-13-22)28-11-10-26(37(40)41)21-27(28)31(38)33-24-6-8-25(9-7-24)34-16-18-36(19-17-34)32(39)30-20-23-4-2-3-5-29(23)42-30/h2-11,20-22H,12-19H2,1H3,(H,33,38)