3-nitro-4-piperidin-1-yl-N-(2-propan-2-ylphenyl)benzamide

Systemtic Name: 3-nitro-4-piperidin-1-yl-N-(2-propan-2-ylphenyl)benzamide Openeye Name: N-(2-isopropylphenyl)-3-nitro-4-(1-piperidyl)benzamide CAS Name: 3-nitro-4-(1-piperidinyl)-N-(2-propan-2-ylphenyl)benzamide IUPAC Name: 3-nitro-4-piperidin-1-yl-N-(2-propan-2-ylphenyl)benzamide Traditional Name: 3-nitro-N-o-cumenyl-4-piperidino-benzamide Formula: C21H25N3O3 MolecularWeight: 367.4415

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1NC(=O)C2=CC(=C(C=C2)N3CCCCC3)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=CC=CC=C1NC(=O)C2=CC(=C(C=C2)N3CCCCC3)[N+](=O)[O-]

InChI

InChI=1S/C21H25N3O3/c1-15(2)17-8-4-5-9-18(17)22-21(25)16-10-11-19(20(14-16)24(26)27)23-12-6-3-7-13-23/h4-5,8-11,14-15H,3,6-7,12-13H2,1-2H3,(H,22,25)