2-[[2-[(4-butylphenyl)amino]purin-9-yl]methoxy]ethanol

Systemtic Name: 2-[[2-[(4-butylphenyl)amino]purin-9-yl]methoxy]ethanol Openeye Name: 2-[[2-(4-butylanilino)purin-9-yl]methoxy]ethanol CAS Name: 2-[[2-(4-butylanilino)-9-purinyl]methoxy]ethanol IUPAC Name: 2-[[2-(4-butylanilino)purin-9-yl]methoxy]ethanol Traditional Name: 2-[[2-(4-butylanilino)purin-9-yl]methoxy]ethanol Formula: C18H23N5O2 MolecularWeight: 341.40752

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC2=NC=C3C(=N2)N(C=N3)COCCO

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC2=NC=C3C(=N2)N(C=N3)COCCO

InChI

InChI=1S/C18H23N5O2/c1-2-3-4-14-5-7-15(8-6-14)21-18-19-11-16-17(22-18)23(12-20-16)13-25-10-9-24/h5-8,11-12,24H,2-4,9-10,13H2,1H3,(H,19,21,22)