3-fluoranyl-4-[(phenylmethyl)-propan-2-yl-amino]benzenecarbonitrile

Systemtic Name: 3-fluoranyl-4-[(phenylmethyl)-propan-2-yl-amino]benzenecarbonitrile Openeye Name: 4-[benzyl(isopropyl)amino]-3-fluoro-benzonitrile CAS Name: 3-fluoro-4-[(phenylmethyl)-propan-2-ylamino]benzonitrile IUPAC Name: 4-[benzyl(propan-2-yl)amino]-3-fluorobenzonitrile Traditional Name: 4-[benzyl(isopropyl)amino]-3-fluoro-benzonitrile Formula: C17H17FN2 MolecularWeight: 268.328683

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC1=CC=CC=C1)C2=C(C=C(C=C2)C#N)F

Isomeric SMILES

CC(C)N(CC1=CC=CC=C1)C2=C(C=C(C=C2)C#N)F

InChI

InChI=1S/C17H17FN2/c1-13(2)20(12-14-6-4-3-5-7-14)17-9-8-15(11-19)10-16(17)18/h3-10,13H,12H2,1-2H3