4-[2-(6-phenylazanylpurin-9-yl)ethoxy]benzaldehyde

Systemtic Name: 4-[2-(6-phenylazanylpurin-9-yl)ethoxy]benzaldehyde Openeye Name: 4-[2-(6-anilinopurin-9-yl)ethoxy]benzaldehyde CAS Name: 4-[2-(6-anilino-9-purinyl)ethoxy]benzaldehyde IUPAC Name: 4-[2-(6-anilinopurin-9-yl)ethoxy]benzaldehyde Traditional Name: 4-[2-(6-anilinopurin-9-yl)ethoxy]benzaldehyde Formula: C20H17N5O2 MolecularWeight: 359.38128

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NC=NC3=C2N=CN3CCOC4=CC=C(C=C4)C=O

Isomeric SMILES

C1=CC=C(C=C1)NC2=NC=NC3=C2N=CN3CCOC4=CC=C(C=C4)C=O

InChI

InChI=1S/C20H17N5O2/c26-12-15-6-8-17(9-7-15)27-11-10-25-14-23-18-19(21-13-22-20(18)25)24-16-4-2-1-3-5-16/h1-9,12-14H,10-11H2,(H,21,22,24)