1-(4-bromophenyl)-2-[(2,4-dimethoxyphenyl)-(3,4,5,6-tetrahydro-2H-azepin-7-yl)amino]ethanone

Systemtic Name: 1-(4-bromophenyl)-2-[(2,4-dimethoxyphenyl)-(3,4,5,6-tetrahydro-2H-azepin-7-yl)amino]ethanone Openeye Name: 1-(4-bromophenyl)-2-[2,4-dimethoxy-N-(3,4,5,6-tetrahydro-2H-azepin-7-yl)anilino]ethanone CAS Name: 1-(4-bromophenyl)-2-[2,4-dimethoxy-N-(3,4,5,6-tetrahydro-2H-azepin-7-yl)anilino]ethanone IUPAC Name: 1-(4-bromophenyl)-2-[2,4-dimethoxy-N-(3,4,5,6-tetrahydro-2H-azepin-7-yl)anilino]ethanone Traditional Name: 1-(4-bromophenyl)-2-[2,4-dimethoxy-N-(3,4,5,6-tetrahydro-2H-azepin-7-yl)anilino]ethanone Formula: C22H25BrN2O3 MolecularWeight: 445.3495

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)N(CC(=O)C2=CC=C(C=C2)Br)C3=NCCCCC3)OC

Isomeric SMILES

COC1=CC(=C(C=C1)N(CC(=O)C2=CC=C(C=C2)Br)C3=NCCCCC3)OC

InChI

InChI=1S/C22H25BrN2O3/c1-27-18-11-12-19(21(14-18)28-2)25(22-6-4-3-5-13-24-22)15-20(26)16-7-9-17(23)10-8-16/h7-12,14H,3-6,13,15H2,1-2H3