3,4,5-trimethoxy-N-[3-(6-phenylmethoxypurin-9-yl)propyl]aniline

Systemtic Name: 3,4,5-trimethoxy-N-[3-(6-phenylmethoxypurin-9-yl)propyl]aniline Openeye Name: N-[3-(6-benzyloxypurin-9-yl)propyl]-3,4,5-trimethoxy-aniline CAS Name: 3,4,5-trimethoxy-N-[3-(6-phenylmethoxy-9-purinyl)propyl]aniline IUPAC Name: 3,4,5-trimethoxy-N-[3-(6-phenylmethoxypurin-9-yl)propyl]aniline Traditional Name: 3-(6-benzoxypurin-9-yl)propyl-(3,4,5-trimethoxyphenyl)amine Formula: C24H27N5O4 MolecularWeight: 449.50228

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)NCCCN2C=NC3=C2N=CN=C3OCC4=CC=CC=C4

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)NCCCN2C=NC3=C2N=CN=C3OCC4=CC=CC=C4

InChI

InChI=1S/C24H27N5O4/c1-30-19-12-18(13-20(31-2)22(19)32-3)25-10-7-11-29-16-28-21-23(29)26-15-27-24(21)33-14-17-8-5-4-6-9-17/h4-6,8-9,12-13,15-16,25H,7,10-11,14H2,1-3H3