methyl 9-[6-[cyclohexyl(prop-2-enyl)amino]purin-9-yl]nonanoate

Systemtic Name: methyl 9-[6-[cyclohexyl(prop-2-enyl)amino]purin-9-yl]nonanoate Openeye Name: methyl 9-[6-[allyl(cyclohexyl)amino]purin-9-yl]nonanoate CAS Name: 9-[6-[cyclohexyl(prop-2-enyl)amino]-9-purinyl]nonanoic acid methyl ester IUPAC Name: methyl 9-[6-[cyclohexyl(prop-2-enyl)amino]purin-9-yl]nonanoate Traditional Name: 9-[6-[allyl(cyclohexyl)amino]purin-9-yl]pelargonic acid methyl ester Formula: C24H37N5O2 MolecularWeight: 427.58288

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCCCCN1C=NC2=C1N=CN=C2N(CC=C)C3CCCCC3

Isomeric SMILES

COC(=O)CCCCCCCCN1C=NC2=C1N=CN=C2N(CC=C)C3CCCCC3

InChI

InChI=1S/C24H37N5O2/c1-3-16-29(20-13-9-8-10-14-20)24-22-23(25-18-26-24)28(19-27-22)17-12-7-5-4-6-11-15-21(30)31-2/h3,18-20H,1,4-17H2,2H3