2-azanyl-4-(1,3-benzodioxol-5-yl)-6-(4-ethylphenyl)pyridine-3-carbonitrile

Systemtic Name: 2-azanyl-4-(1,3-benzodioxol-5-yl)-6-(4-ethylphenyl)pyridine-3-carbonitrile Openeye Name: 2-amino-4-(1,3-benzodioxol-5-yl)-6-(4-ethylphenyl)pyridine-3-carbonitrile CAS Name: 2-amino-4-(1,3-benzodioxol-5-yl)-6-(4-ethylphenyl)-3-pyridinecarbonitrile IUPAC Name: 2-amino-4-(1,3-benzodioxol-5-yl)-6-(4-ethylphenyl)pyridine-3-carbonitrile Traditional Name: 2-amino-4-(1,3-benzodioxol-5-yl)-6-(4-ethylphenyl)nicotinonitrile Formula: C21H17N3O2 MolecularWeight: 343.37858

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NC(=C(C(=C2)C3=CC4=C(C=C3)OCO4)C#N)N

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NC(=C(C(=C2)C3=CC4=C(C=C3)OCO4)C#N)N

InChI

InChI=1S/C21H17N3O2/c1-2-13-3-5-14(6-4-13)18-10-16(17(11-22)21(23)24-18)15-7-8-19-20(9-15)26-12-25-19/h3-10H,2,12H2,1H3,(H2,23,24)