(3-bromanyl-4-ethoxy-phenyl)-[4-(3-bromanyl-4-ethoxy-phenyl)carbonyl-1,4-diazepan-1-yl]methanone

Systemtic Name: (3-bromanyl-4-ethoxy-phenyl)-[4-(3-bromanyl-4-ethoxy-phenyl)carbonyl-1,4-diazepan-1-yl]methanone Openeye Name: [4-(3-bromo-4-ethoxy-benzoyl)-1,4-diazepan-1-yl]-(3-bromo-4-ethoxy-phenyl)methanone CAS Name: (3-bromo-4-ethoxyphenyl)-[4-[(3-bromo-4-ethoxyphenyl)-oxomethyl]-1,4-diazepan-1-yl]methanone IUPAC Name: [4-(3-bromo-4-ethoxybenzoyl)-1,4-diazepan-1-yl]-(3-bromo-4-ethoxyphenyl)methanone Traditional Name: [4-(3-bromo-4-ethoxy-benzoyl)-1,4-diazepan-1-yl]-(3-bromo-4-ethoxy-phenyl)methanone Formula: C23H26Br2N2O4 MolecularWeight: 554.27154

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)N2CCCN(CC2)C(=O)C3=CC(=C(C=C3)OCC)Br)Br

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)N2CCCN(CC2)C(=O)C3=CC(=C(C=C3)OCC)Br)Br

InChI

InChI=1S/C23H26Br2N2O4/c1-3-30-20-8-6-16(14-18(20)24)22(28)26-10-5-11-27(13-12-26)23(29)17-7-9-21(31-4-2)19(25)15-17/h6-9,14-15H,3-5,10-13H2,1-2H3