N-[2-chloranyl-5-[5-(hydroxymethyl)furan-2-yl]phenyl]-2-(4-methylpiperidin-1-yl)-5-nitro-benzamide

Systemtic Name: N-[2-chloranyl-5-[5-(hydroxymethyl)furan-2-yl]phenyl]-2-(4-methylpiperidin-1-yl)-5-nitro-benzamide Openeye Name: N-[2-chloro-5-[5-(hydroxymethyl)-2-furyl]phenyl]-2-(4-methyl-1-piperidyl)-5-nitro-benzamide CAS Name: N-[2-chloro-5-[5-(hydroxymethyl)-2-furanyl]phenyl]-2-(4-methyl-1-piperidinyl)-5-nitrobenzamide IUPAC Name: N-[2-chloro-5-[5-(hydroxymethyl)furan-2-yl]phenyl]-2-(4-methylpiperidin-1-yl)-5-nitrobenzamide Traditional Name: N-[2-chloro-5-(5-methylol-2-furyl)phenyl]-2-(4-methylpiperidino)-5-nitro-benzamide Formula: C24H24ClN3O5 MolecularWeight: 469.91746

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NC3=C(C=CC(=C3)C4=CC=C(O4)CO)Cl

Isomeric SMILES

CC1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NC3=C(C=CC(=C3)C4=CC=C(O4)CO)Cl

InChI

InChI=1S/C24H24ClN3O5/c1-15-8-10-27(11-9-15)22-6-3-17(28(31)32)13-19(22)24(30)26-21-12-16(2-5-20(21)25)23-7-4-18(14-29)33-23/h2-7,12-13,15,29H,8-11,14H2,1H3,(H,26,30)