2-bromanyl-N-[2-chloranyl-5-(1,4-diazepan-1-ylcarbonyl)phenyl]-5-methoxy-benzamide

Systemtic Name: 2-bromanyl-N-[2-chloranyl-5-(1,4-diazepan-1-ylcarbonyl)phenyl]-5-methoxy-benzamide Openeye Name: 2-bromo-N-[2-chloro-5-(1,4-diazepane-1-carbonyl)phenyl]-5-methoxy-benzamide CAS Name: 2-bromo-N-[2-chloro-5-[1,4-diazepan-1-yl(oxo)methyl]phenyl]-5-methoxybenzamide IUPAC Name: 2-bromo-N-[2-chloro-5-(1,4-diazepane-1-carbonyl)phenyl]-5-methoxybenzamide Traditional Name: 2-bromo-N-[2-chloro-5-(1,4-diazepane-1-carbonyl)phenyl]-5-methoxy-benzamide Formula: C20H21BrClN3O3 MolecularWeight: 466.75604

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)Br)C(=O)NC2=C(C=CC(=C2)C(=O)N3CCCNCC3)Cl

Isomeric SMILES

COC1=CC(=C(C=C1)Br)C(=O)NC2=C(C=CC(=C2)C(=O)N3CCCNCC3)Cl

InChI

InChI=1S/C20H21BrClN3O3/c1-28-14-4-5-16(21)15(12-14)19(26)24-18-11-13(3-6-17(18)22)20(27)25-9-2-7-23-8-10-25/h3-6,11-12,23H,2,7-10H2,1H3,(H,24,26)