N-(2-bromanyl-4-methyl-phenyl)-5-nitro-2-piperidin-1-yl-benzamide

Systemtic Name: N-(2-bromanyl-4-methyl-phenyl)-5-nitro-2-piperidin-1-yl-benzamide Openeye Name: N-(2-bromo-4-methyl-phenyl)-5-nitro-2-(1-piperidyl)benzamide CAS Name: N-(2-bromo-4-methylphenyl)-5-nitro-2-(1-piperidinyl)benzamide IUPAC Name: N-(2-bromo-4-methylphenyl)-5-nitro-2-piperidin-1-ylbenzamide Traditional Name: N-(2-bromo-4-methyl-phenyl)-5-nitro-2-piperidino-benzamide Formula: C19H20BrN3O3 MolecularWeight: 418.2844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCCCC3)Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCCCC3)Br

InChI

InChI=1S/C19H20BrN3O3/c1-13-5-7-17(16(20)11-13)21-19(24)15-12-14(23(25)26)6-8-18(15)22-9-3-2-4-10-22/h5-8,11-12H,2-4,9-10H2,1H3,(H,21,24)