2-azanyl-4-[5-[(4-bromanylphenoxy)methyl]furan-2-yl]-5,6,7,8-tetrahydroquinolin-1-ium-3-carbonitrile

Systemtic Name: 2-azanyl-4-[5-[(4-bromanylphenoxy)methyl]furan-2-yl]-5,6,7,8-tetrahydroquinolin-1-ium-3-carbonitrile Openeye Name: 2-amino-4-[5-[(4-bromophenoxy)methyl]-2-furyl]-5,6,7,8-tetrahydroquinolin-1-ium-3-carbonitrile CAS Name: 2-amino-4-[5-[(4-bromophenoxy)methyl]-2-furanyl]-5,6,7,8-tetrahydroquinolin-1-ium-3-carbonitrile IUPAC Name: 2-amino-4-[5-[(4-bromophenoxy)methyl]furan-2-yl]-5,6,7,8-tetrahydroquinolin-1-ium-3-carbonitrile Traditional Name: 2-amino-4-[5-[(4-bromophenoxy)methyl]-2-furyl]-5,6,7,8-tetrahydroquinolin-1-ium-3-carbonitrile Formula: C21H19BrN3O2+ MolecularWeight: 425.29846

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(C(=[NH+]2)N)C#N)C3=CC=C(O3)COC4=CC=C(C=C4)Br

Isomeric SMILES

C1CCC2=C(C1)C(=C(C(=[NH+]2)N)C#N)C3=CC=C(O3)COC4=CC=C(C=C4)Br

InChI

InChI=1S/C21H18BrN3O2/c22-13-5-7-14(8-6-13)26-12-15-9-10-19(27-15)20-16-3-1-2-4-18(16)25-21(24)17(20)11-23/h5-10H,1-4,12H2,(H2,24,25)/p+1