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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H17N5O3/c1-14(15-5-3-2-4-6-15)23-18-8-7-17(13-19(18)26(27)28)21-24-20(25-29-21)16-9-11-22-12-10-16/h2-14,23H,1H3