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

Systemtic Name: azepan-2-ylidene-(4-bromophenyl)-[2-oxidanylidene-2-(4-phenylphenyl)ethyl]azanium Openeye Name: azepan-2-ylidene-(4-bromophenyl)-[2-oxo-2-(4-phenylphenyl)ethyl]ammonium CAS Name: 2-azepanylidene-(4-bromophenyl)-[2-oxo-2-(4-phenylphenyl)ethyl]ammonium IUPAC Name: azepan-2-ylidene-(4-bromophenyl)-[2-oxo-2-(4-phenylphenyl)ethyl]azanium Traditional Name: azepan-2-ylidene-(4-bromophenyl)-[2-keto-2-(4-phenylphenyl)ethyl]ammonium Formula: C26H26BrN2O+ MolecularWeight: 462.40144

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=[N+](CC(=O)C2=CC=C(C=C2)C3=CC=CC=C3)C4=CC=C(C=C4)Br)NCC1

Isomeric SMILES

C1CCC(=[N+](CC(=O)C2=CC=C(C=C2)C3=CC=CC=C3)C4=CC=C(C=C4)Br)NCC1

InChI

InChI=1S/C26H25BrN2O/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/h1,3-4,7-8,10-17H,2,5-6,9,18-19H2/p+1