4-[4-[4-azanyl-7-(oxolan-3-yl)pyrrolo[2,3-d]pyrimidin-5-yl]phenoxy]benzaldehyde

Systemtic Name: 4-[4-[4-azanyl-7-(oxolan-3-yl)pyrrolo[2,3-d]pyrimidin-5-yl]phenoxy]benzaldehyde Openeye Name: 4-[4-(4-amino-7-tetrahydrofuran-3-yl-pyrrolo[2,3-d]pyrimidin-5-yl)phenoxy]benzaldehyde CAS Name: 4-[4-[4-amino-7-(3-oxolanyl)-5-pyrrolo[2,3-d]pyrimidinyl]phenoxy]benzaldehyde IUPAC Name: 4-[4-[4-amino-7-(oxolan-3-yl)pyrrolo[2,3-d]pyrimidin-5-yl]phenoxy]benzaldehyde Traditional Name: 4-[4-(4-amino-7-tetrahydrofuran-3-yl-pyrrolo[2,3-d]pyrimidin-5-yl)phenoxy]benzaldehyde Formula: C23H20N4O3 MolecularWeight: 400.4299

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC1N2C=C(C3=C2N=CN=C3N)C4=CC=C(C=C4)OC5=CC=C(C=C5)C=O

Isomeric SMILES

C1COCC1N2C=C(C3=C2N=CN=C3N)C4=CC=C(C=C4)OC5=CC=C(C=C5)C=O

InChI

InChI=1S/C23H20N4O3/c24-22-21-20(11-27(17-9-10-29-13-17)23(21)26-14-25-22)16-3-7-19(8-4-16)30-18-5-1-15(12-28)2-6-18/h1-8,11-12,14,17H,9-10,13H2,(H2,24,25,26)