N-[4-[4-(furan-2-ylcarbonyl)piperazin-1-yl]phenyl]-3-nitro-4-piperidin-1-yl-benzamide

Systemtic Name: N-[4-[4-(furan-2-ylcarbonyl)piperazin-1-yl]phenyl]-3-nitro-4-piperidin-1-yl-benzamide Openeye Name: N-[4-[4-(furan-2-carbonyl)piperazin-1-yl]phenyl]-3-nitro-4-(1-piperidyl)benzamide CAS Name: N-[4-[4-[2-furanyl(oxo)methyl]-1-piperazinyl]phenyl]-3-nitro-4-(1-piperidinyl)benzamide IUPAC Name: N-[4-[4-(furan-2-carbonyl)piperazin-1-yl]phenyl]-3-nitro-4-piperidin-1-ylbenzamide Traditional Name: N-[4-[4-(2-furoyl)piperazino]phenyl]-3-nitro-4-piperidino-benzamide Formula: C27H29N5O5 MolecularWeight: 503.54966

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)N4CCN(CC4)C(=O)C5=CC=CO5)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)N4CCN(CC4)C(=O)C5=CC=CO5)[N+](=O)[O-]

InChI

InChI=1S/C27H29N5O5/c33-26(20-6-11-23(24(19-20)32(35)36)30-12-2-1-3-13-30)28-21-7-9-22(10-8-21)29-14-16-31(17-15-29)27(34)25-5-4-18-37-25/h4-11,18-19H,1-3,12-17H2,(H,28,33)