2-(1,3-benzodioxol-5-ylamino)-5-phenyl-pyridine-3-carbonitrile

Systemtic Name: 2-(1,3-benzodioxol-5-ylamino)-5-phenyl-pyridine-3-carbonitrile Openeye Name: 2-(1,3-benzodioxol-5-ylamino)-5-phenyl-pyridine-3-carbonitrile CAS Name: 2-(1,3-benzodioxol-5-ylamino)-5-phenyl-3-pyridinecarbonitrile IUPAC Name: 2-(1,3-benzodioxol-5-ylamino)-5-phenylpyridine-3-carbonitrile Traditional Name: 2-(1,3-benzodioxol-5-ylamino)-5-phenyl-nicotinonitrile Formula: C19H13N3O2 MolecularWeight: 315.32542

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC3=NC=C(C=C3C#N)C4=CC=CC=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC3=NC=C(C=C3C#N)C4=CC=CC=C4

InChI

InChI=1S/C19H13N3O2/c20-10-14-8-15(13-4-2-1-3-5-13)11-21-19(14)22-16-6-7-17-18(9-16)24-12-23-17/h1-9,11H,12H2,(H,21,22)