N-[2-(2-bromanyl-4,5-dimethoxy-phenyl)ethyl]-3-(2-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl)propanamide

Systemtic Name: N-[2-(2-bromanyl-4,5-dimethoxy-phenyl)ethyl]-3-(2-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl)propanamide Openeye Name: N-[2-(2-bromo-4,5-dimethoxy-phenyl)ethyl]-3-(2-methyl-3-oxo-1,4-benzoxazin-4-yl)propanamide CAS Name: N-[2-(2-bromo-4,5-dimethoxyphenyl)ethyl]-3-(2-methyl-3-oxo-1,4-benzoxazin-4-yl)propanamide IUPAC Name: N-[2-(2-bromo-4,5-dimethoxyphenyl)ethyl]-3-(2-methyl-3-oxo-1,4-benzoxazin-4-yl)propanamide Traditional Name: N-[2-(2-bromo-4,5-dimethoxy-phenyl)ethyl]-3-(3-keto-2-methyl-1,4-benzoxazin-4-yl)propionamide Formula: C22H25BrN2O5 MolecularWeight: 477.3483

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(C2=CC=CC=C2O1)CCC(=O)NCCC3=CC(=C(C=C3Br)OC)OC

Isomeric SMILES

CC1C(=O)N(C2=CC=CC=C2O1)CCC(=O)NCCC3=CC(=C(C=C3Br)OC)OC

InChI

InChI=1S/C22H25BrN2O5/c1-14-22(27)25(17-6-4-5-7-18(17)30-14)11-9-21(26)24-10-8-15-12-19(28-2)20(29-3)13-16(15)23/h4-7,12-14H,8-11H2,1-3H3,(H,24,26)