N-(5-iodanyl-6-methyl-pyridin-2-yl)-3-nitro-4-pyrrolidin-1-yl-benzamide

Systemtic Name: N-(5-iodanyl-6-methyl-pyridin-2-yl)-3-nitro-4-pyrrolidin-1-yl-benzamide Openeye Name: N-(5-iodo-6-methyl-2-pyridyl)-3-nitro-4-pyrrolidin-1-yl-benzamide CAS Name: N-(5-iodo-6-methyl-2-pyridinyl)-3-nitro-4-(1-pyrrolidinyl)benzamide IUPAC Name: N-(5-iodo-6-methylpyridin-2-yl)-3-nitro-4-pyrrolidin-1-ylbenzamide Traditional Name: N-(5-iodo-6-methyl-2-pyridyl)-3-nitro-4-pyrrolidino-benzamide Formula: C17H17IN4O3 MolecularWeight: 452.24635

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=N1)NC(=O)C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-])I

Isomeric SMILES

CC1=C(C=CC(=N1)NC(=O)C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-])I

InChI

InChI=1S/C17H17IN4O3/c1-11-13(18)5-7-16(19-11)20-17(23)12-4-6-14(15(10-12)22(24)25)21-8-2-3-9-21/h4-7,10H,2-3,8-9H2,1H3,(H,19,20,23)