2-(4,4-diethoxypiperidin-1-yl)-N,9-bis(prop-2-enyl)purin-6-amine

Systemtic Name: 2-(4,4-diethoxypiperidin-1-yl)-N,9-bis(prop-2-enyl)purin-6-amine Openeye Name: N,9-diallyl-2-(4,4-diethoxy-1-piperidyl)purin-6-amine CAS Name: 2-(4,4-diethoxy-1-piperidinyl)-N,9-bis(prop-2-enyl)-6-purinamine IUPAC Name: 2-(4,4-diethoxypiperidin-1-yl)-N,9-bis(prop-2-enyl)purin-6-amine Traditional Name: allyl-[9-allyl-2-(4,4-diethoxypiperidino)purin-6-yl]amine Formula: C20H30N6O2 MolecularWeight: 386.4912

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1(CCN(CC1)C2=NC3=C(C(=N2)NCC=C)N=CN3CC=C)OCC

Isomeric SMILES

CCOC1(CCN(CC1)C2=NC3=C(C(=N2)NCC=C)N=CN3CC=C)OCC

InChI

InChI=1S/C20H30N6O2/c1-5-11-21-17-16-18(26(12-6-2)15-22-16)24-19(23-17)25-13-9-20(10-14-25,27-7-3)28-8-4/h5-6,15H,1-2,7-14H2,3-4H3,(H,21,23,24)