3-bromanyl-4-[[5-(2-methylcyclopropyl)furan-2-yl]methylamino]benzenecarbonitrile

Systemtic Name: 3-bromanyl-4-[[5-(2-methylcyclopropyl)furan-2-yl]methylamino]benzenecarbonitrile Openeye Name: 3-bromo-4-[[5-(2-methylcyclopropyl)-2-furyl]methylamino]benzonitrile CAS Name: 3-bromo-4-[[5-(2-methylcyclopropyl)-2-furanyl]methylamino]benzonitrile IUPAC Name: 3-bromo-4-[[5-(2-methylcyclopropyl)furan-2-yl]methylamino]benzonitrile Traditional Name: 3-bromo-4-[[5-(2-methylcyclopropyl)-2-furyl]methylamino]benzonitrile Formula: C16H15BrN2O MolecularWeight: 331.2071

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC1C2=CC=C(O2)CNC3=C(C=C(C=C3)C#N)Br

Isomeric SMILES

CC1CC1C2=CC=C(O2)CNC3=C(C=C(C=C3)C#N)Br

InChI

InChI=1S/C16H15BrN2O/c1-10-6-13(10)16-5-3-12(20-16)9-19-15-4-2-11(8-18)7-14(15)17/h2-5,7,10,13,19H,6,9H2,1H3