2-[(4-iodanyl-2-methyl-phenyl)amino]-5-nitro-N-(3-piperidin-1-ylpropyl)benzamide

Systemtic Name: 2-[(4-iodanyl-2-methyl-phenyl)amino]-5-nitro-N-(3-piperidin-1-ylpropyl)benzamide Openeye Name: 2-(4-iodo-2-methyl-anilino)-5-nitro-N-[3-(1-piperidyl)propyl]benzamide CAS Name: 2-(4-iodo-2-methylanilino)-5-nitro-N-[3-(1-piperidinyl)propyl]benzamide IUPAC Name: 2-(4-iodo-2-methylanilino)-5-nitro-N-(3-piperidin-1-ylpropyl)benzamide Traditional Name: 2-(4-iodo-2-methyl-anilino)-5-nitro-N-(3-piperidinopropyl)benzamide Formula: C22H27IN4O3 MolecularWeight: 522.37925

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)I)NC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NCCCN3CCCCC3

Isomeric SMILES

CC1=C(C=CC(=C1)I)NC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NCCCN3CCCCC3

InChI

InChI=1S/C22H27IN4O3/c1-16-14-17(23)6-8-20(16)25-21-9-7-18(27(29)30)15-19(21)22(28)24-10-5-13-26-11-3-2-4-12-26/h6-9,14-15,25H,2-5,10-13H2,1H3,(H,24,28)