N-(5-tert-butyl-2-methoxy-phenyl)-3-nitro-4-piperidin-1-yl-benzamide

Systemtic Name: N-(5-tert-butyl-2-methoxy-phenyl)-3-nitro-4-piperidin-1-yl-benzamide Openeye Name: N-(5-tert-butyl-2-methoxy-phenyl)-3-nitro-4-(1-piperidyl)benzamide CAS Name: N-(5-tert-butyl-2-methoxyphenyl)-3-nitro-4-(1-piperidinyl)benzamide IUPAC Name: N-(5-tert-butyl-2-methoxyphenyl)-3-nitro-4-piperidin-1-ylbenzamide Traditional Name: N-(5-tert-butyl-2-methoxy-phenyl)-3-nitro-4-piperidino-benzamide Formula: C23H29N3O4 MolecularWeight: 411.49406

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H29N3O4/c1-23(2,3)17-9-11-21(30-4)18(15-17)24-22(27)16-8-10-19(20(14-16)26(28)29)25-12-6-5-7-13-25/h8-11,14-15H,5-7,12-13H2,1-4H3,(H,24,27)