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

Systemtic Name: N-(4-methyl-2-nitro-phenyl)-3-nitro-4-piperidin-1-yl-benzamide Openeye Name: N-(4-methyl-2-nitro-phenyl)-3-nitro-4-(1-piperidyl)benzamide CAS Name: N-(4-methyl-2-nitrophenyl)-3-nitro-4-(1-piperidinyl)benzamide IUPAC Name: N-(4-methyl-2-nitrophenyl)-3-nitro-4-piperidin-1-ylbenzamide Traditional Name: N-(4-methyl-2-nitro-phenyl)-3-nitro-4-piperidino-benzamide Formula: C19H20N4O5 MolecularWeight: 384.3859

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20N4O5/c1-13-5-7-15(17(11-13)22(25)26)20-19(24)14-6-8-16(18(12-14)23(27)28)21-9-3-2-4-10-21/h5-8,11-12H,2-4,9-10H2,1H3,(H,20,24)