azepan-2-ylidene-(4-bromophenyl)-[2-(4-cyclohexylphenyl)-2-oxidanylidene-ethyl]azanium

Systemtic Name: azepan-2-ylidene-(4-bromophenyl)-[2-(4-cyclohexylphenyl)-2-oxidanylidene-ethyl]azanium Openeye Name: azepan-2-ylidene-(4-bromophenyl)-[2-(4-cyclohexylphenyl)-2-oxo-ethyl]ammonium CAS Name: 2-azepanylidene-(4-bromophenyl)-[2-(4-cyclohexylphenyl)-2-oxoethyl]ammonium IUPAC Name: azepan-2-ylidene-(4-bromophenyl)-[2-(4-cyclohexylphenyl)-2-oxoethyl]azanium Traditional Name: azepan-2-ylidene-(4-bromophenyl)-[2-(4-cyclohexylphenyl)-2-keto-ethyl]ammonium Formula: C26H32BrN2O+ MolecularWeight: 468.44908

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=CC=C(C=C2)C(=O)C[N+](=C3CCCCCN3)C4=CC=C(C=C4)Br

Isomeric SMILES

C1CCC(CC1)C2=CC=C(C=C2)C(=O)C[N+](=C3CCCCCN3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C26H31BrN2O/c27-23-14-16-24(17-15-23)29(26-9-5-2-6-18-28-26)19-25(30)22-12-10-21(11-13-22)20-7-3-1-4-8-20/h10-17,20H,1-9,18-19H2/p+1