N-[1-(4-methylphenyl)ethyl]-2-nitro-4-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)aniline

Systemtic Name: N-[1-(4-methylphenyl)ethyl]-2-nitro-4-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)aniline Openeye Name: 2-nitro-N-[1-(p-tolyl)ethyl]-4-[3-(3-pyridyl)-1,2,4-oxadiazol-5-yl]aniline CAS Name: N-[1-(4-methylphenyl)ethyl]-2-nitro-4-[3-(3-pyridinyl)-1,2,4-oxadiazol-5-yl]aniline IUPAC Name: N-[1-(4-methylphenyl)ethyl]-2-nitro-4-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)aniline Traditional Name: [2-nitro-4-[3-(3-pyridyl)-1,2,4-oxadiazol-5-yl]phenyl]-[1-(p-tolyl)ethyl]amine Formula: C22H19N5O3 MolecularWeight: 401.41796

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C)NC2=C(C=C(C=C2)C3=NC(=NO3)C4=CN=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C(C)NC2=C(C=C(C=C2)C3=NC(=NO3)C4=CN=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H19N5O3/c1-14-5-7-16(8-6-14)15(2)24-19-10-9-17(12-20(19)27(28)29)22-25-21(26-30-22)18-4-3-11-23-13-18/h3-13,15,24H,1-2H3