4-(4-methoxyphenyl)-4-methyl-pent-2-ynenitrile

Systemtic Name: 4-(4-methoxyphenyl)-4-methyl-pent-2-ynenitrile Openeye Name: 4-(4-methoxyphenyl)-4-methyl-pent-2-ynenitrile CAS Name: 4-(4-methoxyphenyl)-4-methyl-2-pentynenitrile IUPAC Name: 4-(4-methoxyphenyl)-4-methylpent-2-ynenitrile Traditional Name: 4-(4-methoxyphenyl)-4-methyl-pent-2-ynenitrile Formula: C13H13NO MolecularWeight: 199.24842

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#CC#N)C1=CC=C(C=C1)OC

Isomeric SMILES

CC(C)(C#CC#N)C1=CC=C(C=C1)OC

InChI

InChI=1S/C13H13NO/c1-13(2,9-4-10-14)11-5-7-12(15-3)8-6-11/h5-8H,1-3H3