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

Systemtic Name: 2-[(4-iodanyl-2-methyl-phenyl)amino]-5-nitro-N-(2-piperidin-1-ylethyl)benzamide Openeye Name: 2-(4-iodo-2-methyl-anilino)-5-nitro-N-[2-(1-piperidyl)ethyl]benzamide CAS Name: 2-(4-iodo-2-methylanilino)-5-nitro-N-[2-(1-piperidinyl)ethyl]benzamide IUPAC Name: 2-(4-iodo-2-methylanilino)-5-nitro-N-(2-piperidin-1-ylethyl)benzamide Traditional Name: 2-(4-iodo-2-methyl-anilino)-5-nitro-N-(2-piperidinoethyl)benzamide Formula: C21H25IN4O3 MolecularWeight: 508.35267

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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)NCCN3CCCCC3

Isomeric SMILES

CC1=C(C=CC(=C1)I)NC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NCCN3CCCCC3

InChI

InChI=1S/C21H25IN4O3/c1-15-13-16(22)5-7-19(15)24-20-8-6-17(26(28)29)14-18(20)21(27)23-9-12-25-10-3-2-4-11-25/h5-8,13-14,24H,2-4,9-12H2,1H3,(H,23,27)