9-[(E)-but-2-enyl]-8-[(3,4,5-trimethoxyphenyl)methyl]purin-6-amine

Systemtic Name: 9-[(E)-but-2-enyl]-8-[(3,4,5-trimethoxyphenyl)methyl]purin-6-amine Openeye Name: 9-[(E)-but-2-enyl]-8-[(3,4,5-trimethoxyphenyl)methyl]purin-6-amine CAS Name: 9-[(E)-but-2-enyl]-8-[(3,4,5-trimethoxyphenyl)methyl]-6-purinamine IUPAC Name: 9-[(E)-but-2-enyl]-8-[(3,4,5-trimethoxyphenyl)methyl]purin-6-amine Traditional Name: [9-[(E)-but-2-enyl]-8-(3,4,5-trimethoxybenzyl)purin-6-yl]amine Formula: C19H23N5O3 MolecularWeight: 369.41762

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Descriptors Computed from Structure

Canonical SMILES:

CC=CCN1C(=NC2=C1N=CN=C2N)CC3=CC(=C(C(=C3)OC)OC)OC

Isomeric SMILES

C/C=C/CN1C(=NC2=C1N=CN=C2N)CC3=CC(=C(C(=C3)OC)OC)OC

InChI

InChI=1S/C19H23N5O3/c1-5-6-7-24-15(23-16-18(20)21-11-22-19(16)24)10-12-8-13(25-2)17(27-4)14(9-12)26-3/h5-6,8-9,11H,7,10H2,1-4H3,(H2,20,21,22)/b6-5+