2-[[[2-(aminomethyl)phenyl]methyl-methyl-amino]methyl]-5-(6-aminopurin-9-yl)oxolane-3,4-diol

Systemtic Name: 2-[[[2-(aminomethyl)phenyl]methyl-methyl-amino]methyl]-5-(6-aminopurin-9-yl)oxolane-3,4-diol Openeye Name: 2-[[[2-(aminomethyl)phenyl]methyl-methyl-amino]methyl]-5-(6-aminopurin-9-yl)tetrahydrofuran-3,4-diol CAS Name: 2-[[[2-(aminomethyl)phenyl]methyl-methylamino]methyl]-5-(6-aminopurin-9-yl)oxolane-3,4-diol IUPAC Name: 2-[[[2-(aminomethyl)phenyl]methyl-methylamino]methyl]-5-(6-aminopurin-9-yl)oxolane-3,4-diol Traditional Name: 2-adenin-9-yl-5-[[[2-(aminomethyl)benzyl]-methyl-amino]methyl]tetrahydrofuran-3,4-diol Formula: C19H25N7O3 MolecularWeight: 399.4469

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1C(C(C(O1)N2C=NC3=C2N=CN=C3N)O)O)CC4=CC=CC=C4CN

Isomeric SMILES

CN(CC1C(C(C(O1)N2C=NC3=C2N=CN=C3N)O)O)CC4=CC=CC=C4CN

InChI

InChI=1S/C19H25N7O3/c1-25(7-12-5-3-2-4-11(12)6-20)8-13-15(27)16(28)19(29-13)26-10-24-14-17(21)22-9-23-18(14)26/h2-5,9-10,13,15-16,19,27-28H,6-8,20H2,1H3,(H2,21,22,23)