2-azanyl-4-(1,3-benzodioxol-5-yl)-6-(4-methylphenyl)benzene-1,3-dicarbonitrile

Systemtic Name: 2-azanyl-4-(1,3-benzodioxol-5-yl)-6-(4-methylphenyl)benzene-1,3-dicarbonitrile Openeye Name: 2-amino-4-(1,3-benzodioxol-5-yl)-6-(p-tolyl)benzene-1,3-dicarbonitrile CAS Name: 2-amino-4-(1,3-benzodioxol-5-yl)-6-(4-methylphenyl)benzene-1,3-dicarbonitrile IUPAC Name: 2-amino-4-(1,3-benzodioxol-5-yl)-6-(4-methylphenyl)benzene-1,3-dicarbonitrile Traditional Name: 2-amino-4-(1,3-benzodioxol-5-yl)-6-(p-tolyl)isophthalonitrile Formula: C22H15N3O2 MolecularWeight: 353.3734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=C(C(=C2C#N)N)C#N)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=C(C(=C2C#N)N)C#N)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H15N3O2/c1-13-2-4-14(5-3-13)16-9-17(19(11-24)22(25)18(16)10-23)15-6-7-20-21(8-15)27-12-26-20/h2-9H,12,25H2,1H3