2-bromanyl-4-nitro-N-[phenyl(piperidin-1-ium-1-ylidene)methyl]aniline

Systemtic Name: 2-bromanyl-4-nitro-N-[phenyl(piperidin-1-ium-1-ylidene)methyl]aniline Openeye Name: 2-bromo-4-nitro-N-[phenyl(piperidin-1-ium-1-ylidene)methyl]aniline CAS Name: 2-bromo-4-nitro-N-[phenyl(1-piperidin-1-iumylidene)methyl]aniline IUPAC Name: 2-bromo-4-nitro-N-[phenyl(piperidin-1-ium-1-ylidene)methyl]aniline Traditional Name: (2-bromo-4-nitro-phenyl)-[phenyl(piperidin-1-ium-1-ylidene)methyl]amine Formula: C18H19BrN3O2+ MolecularWeight: 389.26636

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[N+](=C(C2=CC=CC=C2)NC3=C(C=C(C=C3)[N+](=O)[O-])Br)CC1

Isomeric SMILES

C1CC[N+](=C(C2=CC=CC=C2)NC3=C(C=C(C=C3)[N+](=O)[O-])Br)CC1

InChI

InChI=1S/C18H18BrN3O2/c19-16-13-15(22(23)24)9-10-17(16)20-18(14-7-3-1-4-8-14)21-11-5-2-6-12-21/h1,3-4,7-10,13H,2,5-6,11-12H2/p+1