2-[(4-iodanyl-2-methyl-phenyl)amino]-5-nitro-N-(pyridin-4-ylmethyl)benzamide

Systemtic Name: 2-[(4-iodanyl-2-methyl-phenyl)amino]-5-nitro-N-(pyridin-4-ylmethyl)benzamide Openeye Name: 2-(4-iodo-2-methyl-anilino)-5-nitro-N-(4-pyridylmethyl)benzamide CAS Name: 2-(4-iodo-2-methylanilino)-5-nitro-N-(pyridin-4-ylmethyl)benzamide IUPAC Name: 2-(4-iodo-2-methylanilino)-5-nitro-N-(pyridin-4-ylmethyl)benzamide Traditional Name: 2-(4-iodo-2-methyl-anilino)-5-nitro-N-(4-pyridylmethyl)benzamide Formula: C20H17IN4O3 MolecularWeight: 488.27845

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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)NCC3=CC=NC=C3

Isomeric SMILES

CC1=C(C=CC(=C1)I)NC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NCC3=CC=NC=C3

InChI

InChI=1S/C20H17IN4O3/c1-13-10-15(21)2-4-18(13)24-19-5-3-16(25(27)28)11-17(19)20(26)23-12-14-6-8-22-9-7-14/h2-11,24H,12H2,1H3,(H,23,26)