4-(5-cyclohexyl-1,2,4-oxadiazol-3-yl)-2-nitro-N-(pyridin-3-ylmethyl)aniline

Systemtic Name: 4-(5-cyclohexyl-1,2,4-oxadiazol-3-yl)-2-nitro-N-(pyridin-3-ylmethyl)aniline Openeye Name: 4-(5-cyclohexyl-1,2,4-oxadiazol-3-yl)-2-nitro-N-(3-pyridylmethyl)aniline CAS Name: 4-(5-cyclohexyl-1,2,4-oxadiazol-3-yl)-2-nitro-N-(3-pyridinylmethyl)aniline IUPAC Name: 4-(5-cyclohexyl-1,2,4-oxadiazol-3-yl)-2-nitro-N-(pyridin-3-ylmethyl)aniline Traditional Name: [4-(5-cyclohexyl-1,2,4-oxadiazol-3-yl)-2-nitro-phenyl]-(3-pyridylmethyl)amine Formula: C20H21N5O3 MolecularWeight: 379.41244

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=NC(=NO2)C3=CC(=C(C=C3)NCC4=CN=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)C2=NC(=NO2)C3=CC(=C(C=C3)NCC4=CN=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H21N5O3/c26-25(27)18-11-16(8-9-17(18)22-13-14-5-4-10-21-12-14)19-23-20(28-24-19)15-6-2-1-3-7-15/h4-5,8-12,15,22H,1-3,6-7,13H2