5-nitro-N-[[6-[4-(phenylmethyl)piperazin-1-yl]pyridin-3-yl]methyl]furan-2-carboxamide

Systemtic Name: 5-nitro-N-[[6-[4-(phenylmethyl)piperazin-1-yl]pyridin-3-yl]methyl]furan-2-carboxamide Openeye Name: N-[[6-(4-benzylpiperazin-1-yl)-3-pyridyl]methyl]-5-nitro-furan-2-carboxamide CAS Name: 5-nitro-N-[[6-[4-(phenylmethyl)-1-piperazinyl]-3-pyridinyl]methyl]-2-furancarboxamide IUPAC Name: N-[[6-(4-benzylpiperazin-1-yl)pyridin-3-yl]methyl]-5-nitrofuran-2-carboxamide Traditional Name: N-[[6-(4-benzylpiperazino)-3-pyridyl]methyl]-5-nitro-2-furamide Formula: C22H23N5O4 MolecularWeight: 421.44912

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C3=NC=C(C=C3)CNC(=O)C4=CC=C(O4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C3=NC=C(C=C3)CNC(=O)C4=CC=C(O4)[N+](=O)[O-]

InChI

InChI=1S/C22H23N5O4/c28-22(19-7-9-21(31-19)27(29)30)24-15-18-6-8-20(23-14-18)26-12-10-25(11-13-26)16-17-4-2-1-3-5-17/h1-9,14H,10-13,15-16H2,(H,24,28)