N-[2,6-bis(bromanyl)-4-propan-2-yl-phenyl]-4-ethanoyl-1,4-diazepane-1-carboxamide

Systemtic Name: N-[2,6-bis(bromanyl)-4-propan-2-yl-phenyl]-4-ethanoyl-1,4-diazepane-1-carboxamide Openeye Name: 4-acetyl-N-(2,6-dibromo-4-isopropyl-phenyl)-1,4-diazepane-1-carboxamide CAS Name: 4-acetyl-N-(2,6-dibromo-4-propan-2-ylphenyl)-1,4-diazepane-1-carboxamide IUPAC Name: 4-acetyl-N-(2,6-dibromo-4-propan-2-ylphenyl)-1,4-diazepane-1-carboxamide Traditional Name: 4-acetyl-N-(2,6-dibromo-4-isopropyl-phenyl)-1,4-diazepane-1-carboxamide Formula: C17H23Br2N3O2 MolecularWeight: 461.19142

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(C(=C1)Br)NC(=O)N2CCCN(CC2)C(=O)C)Br

Isomeric SMILES

CC(C)C1=CC(=C(C(=C1)Br)NC(=O)N2CCCN(CC2)C(=O)C)Br

InChI

InChI=1S/C17H23Br2N3O2/c1-11(2)13-9-14(18)16(15(19)10-13)20-17(24)22-6-4-5-21(7-8-22)12(3)23/h9-11H,4-8H2,1-3H3,(H,20,24)