4-[(3-bromophenyl)amino]-6-[4-(diethylamino)pyridin-1-ium-1-yl]-1,7-naphthyridine-3-carbonitrile

Systemtic Name: 4-[(3-bromophenyl)amino]-6-[4-(diethylamino)pyridin-1-ium-1-yl]-1,7-naphthyridine-3-carbonitrile Openeye Name: 4-(3-bromoanilino)-6-[4-(diethylamino)pyridin-1-ium-1-yl]-1,7-naphthyridine-3-carbonitrile CAS Name: 4-(3-bromoanilino)-6-[4-(diethylamino)-1-pyridin-1-iumyl]-1,7-naphthyridine-3-carbonitrile IUPAC Name: 4-(3-bromoanilino)-6-[4-(diethylamino)pyridin-1-ium-1-yl]-1,7-naphthyridine-3-carbonitrile Traditional Name: 4-(3-bromoanilino)-6-[4-(diethylamino)pyridin-1-ium-1-yl]-1,7-naphthyridine-3-carbonitrile Formula: C24H22BrN6+ MolecularWeight: 474.37568

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=[N+](C=C1)C2=NC=C3C(=C2)C(=C(C=N3)C#N)NC4=CC(=CC=C4)Br

Isomeric SMILES

CCN(CC)C1=CC=[N+](C=C1)C2=NC=C3C(=C2)C(=C(C=N3)C#N)NC4=CC(=CC=C4)Br

InChI

InChI=1S/C24H22BrN6/c1-3-30(4-2)20-8-10-31(11-9-20)23-13-21-22(16-28-23)27-15-17(14-26)24(21)29-19-7-5-6-18(25)12-19/h5-13,15-16H,3-4H2,1-2H3,(H,27,29)/q+1