N-(2-ethyl-4-iodanyl-phenyl)-3-nitro-4-piperidin-1-yl-benzamide

Systemtic Name: N-(2-ethyl-4-iodanyl-phenyl)-3-nitro-4-piperidin-1-yl-benzamide Openeye Name: N-(2-ethyl-4-iodo-phenyl)-3-nitro-4-(1-piperidyl)benzamide CAS Name: N-(2-ethyl-4-iodophenyl)-3-nitro-4-(1-piperidinyl)benzamide IUPAC Name: N-(2-ethyl-4-iodophenyl)-3-nitro-4-piperidin-1-ylbenzamide Traditional Name: N-(2-ethyl-4-iodo-phenyl)-3-nitro-4-piperidino-benzamide Formula: C20H22IN3O3 MolecularWeight: 479.31145

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)I)NC(=O)C2=CC(=C(C=C2)N3CCCCC3)[N+](=O)[O-]

Isomeric SMILES

CCC1=C(C=CC(=C1)I)NC(=O)C2=CC(=C(C=C2)N3CCCCC3)[N+](=O)[O-]

InChI

InChI=1S/C20H22IN3O3/c1-2-14-12-16(21)7-8-17(14)22-20(25)15-6-9-18(19(13-15)24(26)27)23-10-4-3-5-11-23/h6-9,12-13H,2-5,10-11H2,1H3,(H,22,25)