4-[4-(3-bromanylphenoxy)butanoyl]-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: 4-[4-(3-bromanylphenoxy)butanoyl]-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: 4-[4-(3-bromophenoxy)butanoyl]-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: 4-[4-(3-bromophenoxy)-1-oxobutyl]-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: 4-[4-(3-bromophenoxy)butanoyl]-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: 4-[4-(3-bromophenoxy)butanoyl]-N-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C20H21BrN2O4 MolecularWeight: 433.29574

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1CN(C2=CC=CC=C2O1)C(=O)CCCOC3=CC(=CC=C3)Br

Isomeric SMILES

CNC(=O)C1CN(C2=CC=CC=C2O1)C(=O)CCCOC3=CC(=CC=C3)Br

InChI

InChI=1S/C20H21BrN2O4/c1-22-20(25)18-13-23(16-8-2-3-9-17(16)27-18)19(24)10-5-11-26-15-7-4-6-14(21)12-15/h2-4,6-9,12,18H,5,10-11,13H2,1H3,(H,22,25)