4-[(4-methoxyphenyl)methylamino]benzenecarbonitrile; 1H-1,2,4-triazole

Systemtic Name: 4-[(4-methoxyphenyl)methylamino]benzenecarbonitrile; 1H-1,2,4-triazole Openeye Name: 4-[(4-methoxyphenyl)methylamino]benzonitrile; 1H-1,2,4-triazole CAS Name: 4-[(4-methoxyphenyl)methylamino]benzonitrile; 1H-1,2,4-triazole IUPAC Name: 4-[(4-methoxyphenyl)methylamino]benzonitrile; 1H-1,2,4-triazole Traditional Name: 4-(p-anisylamino)benzonitrile; 1H-1,2,4-triazole Formula: C17H17N5O MolecularWeight: 307.34978

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC2=CC=C(C=C2)C#N.C1=NC=NN1

Isomeric SMILES

COC1=CC=C(C=C1)CNC2=CC=C(C=C2)C#N.C1=NC=NN1

InChI

InChI=1S/C15H14N2O.C2H3N3/c1-18-15-8-4-13(5-9-15)11-17-14-6-2-12(10-16)3-7-14;1-3-2-5-4-1/h2-9,17H,11H2,1H3;1-2H,(H,3,4,5)