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

Systemtic Name: 2-nitro-N-phenethyl-4-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)aniline Openeye Name: 2-nitro-N-phenethyl-4-[3-(3-pyridyl)-1,2,4-oxadiazol-5-yl]aniline CAS Name: 2-nitro-N-phenethyl-4-[3-(3-pyridinyl)-1,2,4-oxadiazol-5-yl]aniline IUPAC Name: 2-nitro-N-phenethyl-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]-phenethyl-amine Formula: C21H17N5O3 MolecularWeight: 387.39138

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC2=C(C=C(C=C2)C3=NC(=NO3)C4=CN=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CCNC2=C(C=C(C=C2)C3=NC(=NO3)C4=CN=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H17N5O3/c27-26(28)19-13-16(21-24-20(25-29-21)17-7-4-11-22-14-17)8-9-18(19)23-12-10-15-5-2-1-3-6-15/h1-9,11,13-14,23H,10,12H2