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

Systemtic Name: 4-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-2-nitro-N-(pyridin-3-ylmethyl)aniline Openeye Name: 4-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-2-nitro-N-(3-pyridylmethyl)aniline CAS Name: 4-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-2-nitro-N-(3-pyridinylmethyl)aniline IUPAC Name: 4-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-2-nitro-N-(pyridin-3-ylmethyl)aniline Traditional Name: [4-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-2-nitro-phenyl]-(3-pyridylmethyl)amine Formula: C21H17N5O4 MolecularWeight: 403.39078

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NOC(=N2)C3=CC(=C(C=C3)NCC4=CN=CC=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C2=NOC(=N2)C3=CC(=C(C=C3)NCC4=CN=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H17N5O4/c1-29-17-7-4-15(5-8-17)20-24-21(30-25-20)16-6-9-18(19(11-16)26(27)28)23-13-14-3-2-10-22-12-14/h2-12,23H,13H2,1H3