1-(4-phenylphenyl)-2-(3,4,5,6-tetrahydro-2H-azepin-7-ylamino)ethanone chloride

Systemtic Name: 1-(4-phenylphenyl)-2-(3,4,5,6-tetrahydro-2H-azepin-7-ylamino)ethanone chloride Openeye Name: 1-(4-phenylphenyl)-2-(3,4,5,6-tetrahydro-2H-azepin-7-ylamino)ethanone chloride CAS Name: 1-(4-phenylphenyl)-2-(3,4,5,6-tetrahydro-2H-azepin-7-ylamino)ethanone chloride IUPAC Name: 1-(4-phenylphenyl)-2-(3,4,5,6-tetrahydro-2H-azepin-7-ylamino)ethanone chloride Traditional Name: 1-(4-phenylphenyl)-2-(3,4,5,6-tetrahydro-2H-azepin-7-ylamino)ethanone chloride Formula: C20H22ClN2O- MolecularWeight: 341.85448

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=NCC1)NCC(=O)C2=CC=C(C=C2)C3=CC=CC=C3.[Cl-]

Isomeric SMILES

C1CCC(=NCC1)NCC(=O)C2=CC=C(C=C2)C3=CC=CC=C3.[Cl-]

InChI

InChI=1S/C20H22N2O.ClH/c23-19(15-22-20-9-5-2-6-14-21-20)18-12-10-17(11-13-18)16-7-3-1-4-8-16;/h1,3-4,7-8,10-13H,2,5-6,9,14-15H2,(H,21,22);1H/p-1