4-[4-[[4-(6-bromanylpyridin-2-yl)carbonylmorpholin-2-yl]methoxy]-3-methoxy-phenyl]butan-2-one

Systemtic Name: 4-[4-[[4-(6-bromanylpyridin-2-yl)carbonylmorpholin-2-yl]methoxy]-3-methoxy-phenyl]butan-2-one Openeye Name: 4-[4-[[4-(6-bromopyridine-2-carbonyl)morpholin-2-yl]methoxy]-3-methoxy-phenyl]butan-2-one CAS Name: 4-[4-[[4-[(6-bromo-2-pyridinyl)-oxomethyl]-2-morpholinyl]methoxy]-3-methoxyphenyl]-2-butanone IUPAC Name: 4-[4-[[4-(6-bromopyridine-2-carbonyl)morpholin-2-yl]methoxy]-3-methoxyphenyl]butan-2-one Traditional Name: 4-[4-[[4-(6-bromopicolinoyl)morpholin-2-yl]methoxy]-3-methoxy-phenyl]butan-2-one Formula: C22H25BrN2O5 MolecularWeight: 477.3483

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC1=CC(=C(C=C1)OCC2CN(CCO2)C(=O)C3=NC(=CC=C3)Br)OC

Isomeric SMILES

CC(=O)CCC1=CC(=C(C=C1)OCC2CN(CCO2)C(=O)C3=NC(=CC=C3)Br)OC

InChI

InChI=1S/C22H25BrN2O5/c1-15(26)6-7-16-8-9-19(20(12-16)28-2)30-14-17-13-25(10-11-29-17)22(27)18-4-3-5-21(23)24-18/h3-5,8-9,12,17H,6-7,10-11,13-14H2,1-2H3