5-[3-(dibutylamino)propylamino]-2-(2-nitrophenyl)-1,3-oxazole-4-carbonitrile

Systemtic Name: 5-[3-(dibutylamino)propylamino]-2-(2-nitrophenyl)-1,3-oxazole-4-carbonitrile Openeye Name: 5-[3-(dibutylamino)propylamino]-2-(2-nitrophenyl)oxazole-4-carbonitrile CAS Name: 5-[3-(dibutylamino)propylamino]-2-(2-nitrophenyl)-4-oxazolecarbonitrile IUPAC Name: 5-[3-(dibutylamino)propylamino]-2-(2-nitrophenyl)-1,3-oxazole-4-carbonitrile Traditional Name: 5-[3-(dibutylamino)propylamino]-2-(2-nitrophenyl)oxazole-4-carbonitrile Formula: C21H29N5O3 MolecularWeight: 399.48666

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)CCCNC1=C(N=C(O1)C2=CC=CC=C2[N+](=O)[O-])C#N

Isomeric SMILES

CCCCN(CCCC)CCCNC1=C(N=C(O1)C2=CC=CC=C2[N+](=O)[O-])C#N

InChI

InChI=1S/C21H29N5O3/c1-3-5-13-25(14-6-4-2)15-9-12-23-21-18(16-22)24-20(29-21)17-10-7-8-11-19(17)26(27)28/h7-8,10-11,23H,3-6,9,12-15H2,1-2H3