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

Systemtic Name: 4-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-2-nitro-N-(pyridin-3-ylmethyl)aniline Openeye Name: 4-[3-(m-tolyl)-1,2,4-oxadiazol-5-yl]-2-nitro-N-(3-pyridylmethyl)aniline CAS Name: 4-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-2-nitro-N-(3-pyridinylmethyl)aniline IUPAC Name: 4-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-2-nitro-N-(pyridin-3-ylmethyl)aniline Traditional Name: [4-[3-(m-tolyl)-1,2,4-oxadiazol-5-yl]-2-nitro-phenyl]-(3-pyridylmethyl)amine Formula: C21H17N5O3 MolecularWeight: 387.39138

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NOC(=N2)C3=CC(=C(C=C3)NCC4=CN=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC(=C1)C2=NOC(=N2)C3=CC(=C(C=C3)NCC4=CN=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H17N5O3/c1-14-4-2-6-16(10-14)20-24-21(29-25-20)17-7-8-18(19(11-17)26(27)28)23-13-15-5-3-9-22-12-15/h2-12,23H,13H2,1H3