N-[3-(purin-9-ylmethyl)phenyl]methanamide

Systemtic Name: N-[3-(purin-9-ylmethyl)phenyl]methanamide Openeye Name: N-[3-(purin-9-ylmethyl)phenyl]formamide CAS Name: N-[3-(9-purinylmethyl)phenyl]formamide IUPAC Name: N-[3-(purin-9-ylmethyl)phenyl]formamide Traditional Name: N-[3-(purin-9-ylmethyl)phenyl]formamide Formula: C13H11N5O MolecularWeight: 253.25934

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC=O)CN2C=NC3=CN=CN=C32

Isomeric SMILES

C1=CC(=CC(=C1)NC=O)CN2C=NC3=CN=CN=C32

InChI

InChI=1S/C13H11N5O/c19-9-17-11-3-1-2-10(4-11)6-18-8-16-12-5-14-7-15-13(12)18/h1-5,7-9H,6H2,(H,17,19)