2-azanyl-9-(1-phenylmethoxydecan-2-yloxymethyl)-3H-purin-6-one

Systemtic Name: 2-azanyl-9-(1-phenylmethoxydecan-2-yloxymethyl)-3H-purin-6-one Openeye Name: 2-amino-9-[1-(benzyloxymethyl)nonoxymethyl]-3H-purin-6-one CAS Name: 2-amino-9-(1-phenylmethoxydecan-2-yloxymethyl)-3H-purin-6-one IUPAC Name: 2-amino-9-(1-phenylmethoxydecan-2-yloxymethyl)-3H-purin-6-one Traditional Name: 2-amino-9-[1-(benzoxymethyl)nonoxymethyl]-3H-purin-6-one Formula: C23H33N5O3 MolecularWeight: 427.53982

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(COCC1=CC=CC=C1)OCN2C=NC3=C2NC(=NC3=O)N

Isomeric SMILES

CCCCCCCCC(COCC1=CC=CC=C1)OCN2C=NC3=C2NC(=NC3=O)N

InChI

InChI=1S/C23H33N5O3/c1-2-3-4-5-6-10-13-19(15-30-14-18-11-8-7-9-12-18)31-17-28-16-25-20-21(28)26-23(24)27-22(20)29/h7-9,11-12,16,19H,2-6,10,13-15,17H2,1H3,(H3,24,26,27,29)