(5-bromanyl-2-propoxy-phenyl)-[4-(5-bromanyl-2-propoxy-phenyl)carbonyl-1,4-diazepan-1-yl]methanone

Systemtic Name: (5-bromanyl-2-propoxy-phenyl)-[4-(5-bromanyl-2-propoxy-phenyl)carbonyl-1,4-diazepan-1-yl]methanone Openeye Name: [4-(5-bromo-2-propoxy-benzoyl)-1,4-diazepan-1-yl]-(5-bromo-2-propoxy-phenyl)methanone CAS Name: (5-bromo-2-propoxyphenyl)-[4-[(5-bromo-2-propoxyphenyl)-oxomethyl]-1,4-diazepan-1-yl]methanone IUPAC Name: [4-(5-bromo-2-propoxybenzoyl)-1,4-diazepan-1-yl]-(5-bromo-2-propoxyphenyl)methanone Traditional Name: [4-(5-bromo-2-propoxy-benzoyl)-1,4-diazepan-1-yl]-(5-bromo-2-propoxy-phenyl)methanone Formula: C25H30Br2N2O4 MolecularWeight: 582.3247

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)Br)C(=O)N2CCCN(CC2)C(=O)C3=C(C=CC(=C3)Br)OCCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)Br)C(=O)N2CCCN(CC2)C(=O)C3=C(C=CC(=C3)Br)OCCC

InChI

InChI=1S/C25H30Br2N2O4/c1-3-14-32-22-8-6-18(26)16-20(22)24(30)28-10-5-11-29(13-12-28)25(31)21-17-19(27)7-9-23(21)33-15-4-2/h6-9,16-17H,3-5,10-15H2,1-2H3