ethyl 4-[[9-[(4-methoxyphenyl)methyl]purin-8-yl]amino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[[9-[(4-methoxyphenyl)methyl]purin-8-yl]amino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[9-[(4-methoxyphenyl)methyl]purin-8-yl]amino]piperidine-1-carboxylate CAS Name: 4-[[9-[(4-methoxyphenyl)methyl]-8-purinyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[9-[(4-methoxyphenyl)methyl]purin-8-yl]amino]piperidine-1-carboxylate Traditional Name: 4-[(9-p-anisylpurin-8-yl)amino]piperidine-1-carboxylic acid ethyl ester Formula: C21H26N6O3 MolecularWeight: 410.46954

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC2=NC3=CN=CN=C3N2CC4=CC=C(C=C4)OC

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC2=NC3=CN=CN=C3N2CC4=CC=C(C=C4)OC

InChI

InChI=1S/C21H26N6O3/c1-3-30-21(28)26-10-8-16(9-11-26)24-20-25-18-12-22-14-23-19(18)27(20)13-15-4-6-17(29-2)7-5-15/h4-7,12,14,16H,3,8-11,13H2,1-2H3,(H,24,25)