N-[3-[6-oxidanylidene-2-(2-propoxyphenyl)-3H-purin-9-yl]nonan-2-yl]benzamide

Systemtic Name: N-[3-[6-oxidanylidene-2-(2-propoxyphenyl)-3H-purin-9-yl]nonan-2-yl]benzamide Openeye Name: N-[1-methyl-2-[6-oxo-2-(2-propoxyphenyl)-3H-purin-9-yl]octyl]benzamide CAS Name: N-[3-[6-oxo-2-(2-propoxyphenyl)-3H-purin-9-yl]nonan-2-yl]benzamide IUPAC Name: N-[3-[6-oxo-2-(2-propoxyphenyl)-3H-purin-9-yl]nonan-2-yl]benzamide Traditional Name: N-[2-[6-keto-2-(2-propoxyphenyl)-3H-purin-9-yl]-1-methyl-octyl]benzamide Formula: C30H37N5O3 MolecularWeight: 515.64648

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C(C)NC(=O)C1=CC=CC=C1)N2C=NC3=C2NC(=NC3=O)C4=CC=CC=C4OCCC

Isomeric SMILES

CCCCCCC(C(C)NC(=O)C1=CC=CC=C1)N2C=NC3=C2NC(=NC3=O)C4=CC=CC=C4OCCC

InChI

InChI=1S/C30H37N5O3/c1-4-6-7-11-17-24(21(3)32-29(36)22-14-9-8-10-15-22)35-20-31-26-28(35)33-27(34-30(26)37)23-16-12-13-18-25(23)38-19-5-2/h8-10,12-16,18,20-21,24H,4-7,11,17,19H2,1-3H3,(H,32,36)(H,33,34,37)