2-azanyl-4-(4-bromophenyl)-6-(2-methylpropyl)pyridin-1-ium-3-carbonitrile

Systemtic Name: 2-azanyl-4-(4-bromophenyl)-6-(2-methylpropyl)pyridin-1-ium-3-carbonitrile Openeye Name: 2-amino-4-(4-bromophenyl)-6-isobutyl-pyridin-1-ium-3-carbonitrile CAS Name: 2-amino-4-(4-bromophenyl)-6-(2-methylpropyl)-3-pyridin-1-iumcarbonitrile IUPAC Name: 2-amino-4-(4-bromophenyl)-6-(2-methylpropyl)pyridin-1-ium-3-carbonitrile Traditional Name: 2-amino-4-(4-bromophenyl)-6-isobutyl-pyridin-1-ium-3-carbonitrile Formula: C16H17BrN3+ MolecularWeight: 331.23028

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=[NH+]C(=C(C(=C1)C2=CC=C(C=C2)Br)C#N)N

Isomeric SMILES

CC(C)CC1=[NH+]C(=C(C(=C1)C2=CC=C(C=C2)Br)C#N)N

InChI

InChI=1S/C16H16BrN3/c1-10(2)7-13-8-14(15(9-18)16(19)20-13)11-3-5-12(17)6-4-11/h3-6,8,10H,7H2,1-2H3,(H2,19,20)/p+1