4-[imidazol-1-yl-(4-methyl-2,3-dihydro-1,4-benzoxazin-7-yl)methyl]benzenecarbonitrile

Systemtic Name: 4-[imidazol-1-yl-(4-methyl-2,3-dihydro-1,4-benzoxazin-7-yl)methyl]benzenecarbonitrile Openeye Name: 4-[imidazol-1-yl-(4-methyl-2,3-dihydro-1,4-benzoxazin-7-yl)methyl]benzonitrile CAS Name: 4-[1-imidazolyl-(4-methyl-2,3-dihydro-1,4-benzoxazin-7-yl)methyl]benzonitrile IUPAC Name: 4-[imidazol-1-yl-(4-methyl-2,3-dihydro-1,4-benzoxazin-7-yl)methyl]benzonitrile Traditional Name: 4-[imidazol-1-yl-(4-methyl-2,3-dihydro-1,4-benzoxazin-7-yl)methyl]benzonitrile Formula: C20H18N4O MolecularWeight: 330.38312

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCOC2=C1C=CC(=C2)C(C3=CC=C(C=C3)C#N)N4C=CN=C4

Isomeric SMILES

CN1CCOC2=C1C=CC(=C2)C(C3=CC=C(C=C3)C#N)N4C=CN=C4

InChI

InChI=1S/C20H18N4O/c1-23-10-11-25-19-12-17(6-7-18(19)23)20(24-9-8-22-14-24)16-4-2-15(13-21)3-5-16/h2-9,12,14,20H,10-11H2,1H3