azepan-2-ylidene-(4-bromophenyl)-phenacyl-azanium

Systemtic Name: azepan-2-ylidene-(4-bromophenyl)-phenacyl-azanium Openeye Name: azepan-2-ylidene-(4-bromophenyl)-phenacyl-ammonium CAS Name: 2-azepanylidene-(4-bromophenyl)-phenacylammonium IUPAC Name: azepan-2-ylidene-(4-bromophenyl)-phenacylazanium Traditional Name: azepan-2-ylidene-(4-bromophenyl)-phenacyl-ammonium Formula: C20H22BrN2O+ MolecularWeight: 386.30548

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21BrN2O/c21-17-10-12-18(13-11-17)23(20-9-5-2-6-14-22-20)15-19(24)16-7-3-1-4-8-16/h1,3-4,7-8,10-13H,2,5-6,9,14-15H2/p+1