4-(4-methoxyphenyl)carbonyl-4-methyl-heptanedinitrile

Systemtic Name: 4-(4-methoxyphenyl)carbonyl-4-methyl-heptanedinitrile Openeye Name: 4-(4-methoxybenzoyl)-4-methyl-heptanedinitrile CAS Name: 4-[(4-methoxyphenyl)-oxomethyl]-4-methylheptanedinitrile IUPAC Name: 4-(4-methoxybenzoyl)-4-methylheptanedinitrile Traditional Name: 4-methyl-4-p-anisoyl-pimelonitrile Formula: C16H18N2O2 MolecularWeight: 270.32632

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18N2O2/c1-16(9-3-11-17,10-4-12-18)15(19)13-5-7-14(20-2)8-6-13/h5-8H,3-4,9-10H2,1-2H3