4-(1,3-benzodioxol-5-yl)-2-(cyclopropylmethylamino)-6-phenylmethoxy-pyridine-3,5-dicarbonitrile

Systemtic Name: 4-(1,3-benzodioxol-5-yl)-2-(cyclopropylmethylamino)-6-phenylmethoxy-pyridine-3,5-dicarbonitrile Openeye Name: 4-(1,3-benzodioxol-5-yl)-2-benzyloxy-6-(cyclopropylmethylamino)pyridine-3,5-dicarbonitrile CAS Name: 4-(1,3-benzodioxol-5-yl)-2-(cyclopropylmethylamino)-6-phenylmethoxypyridine-3,5-dicarbonitrile IUPAC Name: 4-(1,3-benzodioxol-5-yl)-2-(cyclopropylmethylamino)-6-phenylmethoxypyridine-3,5-dicarbonitrile Traditional Name: 4-(1,3-benzodioxol-5-yl)-2-benzoxy-6-(cyclopropylmethylamino)dinicotinonitrile Formula: C25H20N4O3 MolecularWeight: 424.4513

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1CNC2=NC(=C(C(=C2C#N)C3=CC4=C(C=C3)OCO4)C#N)OCC5=CC=CC=C5

Isomeric SMILES

C1CC1CNC2=NC(=C(C(=C2C#N)C3=CC4=C(C=C3)OCO4)C#N)OCC5=CC=CC=C5

InChI

InChI=1S/C25H20N4O3/c26-11-19-23(18-8-9-21-22(10-18)32-15-31-21)20(12-27)25(29-24(19)28-13-16-6-7-16)30-14-17-4-2-1-3-5-17/h1-5,8-10,16H,6-7,13-15H2,(H,28,29)