4-[2-methyl-4-(3-methylphenyl)phenoxy]-5-morpholin-4-yl-benzene-1,2-dicarbonitrile

Systemtic Name: 4-[2-methyl-4-(3-methylphenyl)phenoxy]-5-morpholin-4-yl-benzene-1,2-dicarbonitrile Openeye Name: 4-[2-methyl-4-(m-tolyl)phenoxy]-5-morpholino-phthalonitrile CAS Name: 4-[2-methyl-4-(3-methylphenyl)phenoxy]-5-(4-morpholinyl)benzene-1,2-dicarbonitrile IUPAC Name: 4-[2-methyl-4-(3-methylphenyl)phenoxy]-5-morpholin-4-ylbenzene-1,2-dicarbonitrile Traditional Name: 4-[2-methyl-4-(m-tolyl)phenoxy]-5-morpholino-phthalonitrile Formula: C26H23N3O2 MolecularWeight: 409.47972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=CC(=C(C=C2)OC3=C(C=C(C(=C3)C#N)C#N)N4CCOCC4)C

Isomeric SMILES

CC1=CC=CC(=C1)C2=CC(=C(C=C2)OC3=C(C=C(C(=C3)C#N)C#N)N4CCOCC4)C

InChI

InChI=1S/C26H23N3O2/c1-18-4-3-5-20(12-18)21-6-7-25(19(2)13-21)31-26-15-23(17-28)22(16-27)14-24(26)29-8-10-30-11-9-29/h3-7,12-15H,8-11H2,1-2H3