N-methylmethanamine; 3-propoxy-5-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)benzenecarbonitrile

Systemtic Name: N-methylmethanamine; 3-propoxy-5-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)benzenecarbonitrile Openeye Name: N-methylmethanamine; 3-propoxy-5-[3-(2-pyridyl)-1,2,4-oxadiazol-5-yl]benzonitrile CAS Name: N-methylmethanamine; 3-propoxy-5-[3-(2-pyridinyl)-1,2,4-oxadiazol-5-yl]benzonitrile IUPAC Name: N-methylmethanamine; 3-propoxy-5-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)benzonitrile Traditional Name: dimethylamine; 3-propoxy-5-[3-(2-pyridyl)-1,2,4-oxadiazol-5-yl]benzonitrile Formula: C19H21N5O2 MolecularWeight: 351.40234

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC(=CC(=C1)C2=NC(=NO2)C3=CC=CC=N3)C#N.CNC

Isomeric SMILES

CCCOC1=CC(=CC(=C1)C2=NC(=NO2)C3=CC=CC=N3)C#N.CNC

InChI

InChI=1S/C17H14N4O2.C2H7N/c1-2-7-22-14-9-12(11-18)8-13(10-14)17-20-16(21-23-17)15-5-3-4-6-19-15;1-3-2/h3-6,8-10H,2,7H2,1H3;3H,1-2H3