2-[4-[(2-prop-2-ynoxyphenyl)methylamino]phenyl]ethanenitrile

Systemtic Name: 2-[4-[(2-prop-2-ynoxyphenyl)methylamino]phenyl]ethanenitrile Openeye Name: 2-[4-[(2-prop-2-ynoxyphenyl)methylamino]phenyl]acetonitrile CAS Name: 2-[4-[(2-prop-2-ynoxyphenyl)methylamino]phenyl]acetonitrile IUPAC Name: 2-[4-[(2-prop-2-ynoxyphenyl)methylamino]phenyl]acetonitrile Traditional Name: 2-[4-[(2-propargyloxybenzyl)amino]phenyl]acetonitrile Formula: C18H16N2O MolecularWeight: 276.33244

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Descriptors Computed from Structure

Canonical SMILES:

C#CCOC1=CC=CC=C1CNC2=CC=C(C=C2)CC#N

Isomeric SMILES

C#CCOC1=CC=CC=C1CNC2=CC=C(C=C2)CC#N

InChI

InChI=1S/C18H16N2O/c1-2-13-21-18-6-4-3-5-16(18)14-20-17-9-7-15(8-10-17)11-12-19/h1,3-10,20H,11,13-14H2