1-morpholin-4-ylethyl 6-bromanyl-3-methyl-4-oxidanylidene-2-phenyl-chromene-8-carboxylate

Systemtic Name: 1-morpholin-4-ylethyl 6-bromanyl-3-methyl-4-oxidanylidene-2-phenyl-chromene-8-carboxylate Openeye Name: 1-morpholinoethyl 6-bromo-3-methyl-4-oxo-2-phenyl-chromene-8-carboxylate CAS Name: 6-bromo-3-methyl-4-oxo-2-phenyl-1-benzopyran-8-carboxylic acid 1-(4-morpholinyl)ethyl ester IUPAC Name: 1-morpholin-4-ylethyl 6-bromo-3-methyl-4-oxo-2-phenylchromene-8-carboxylate Traditional Name: 6-bromo-4-keto-3-methyl-2-phenyl-chromene-8-carboxylic acid 1-morpholinoethyl ester Formula: C23H22BrNO5 MolecularWeight: 472.32848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C(C=C(C=C2C1=O)Br)C(=O)OC(C)N3CCOCC3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(OC2=C(C=C(C=C2C1=O)Br)C(=O)OC(C)N3CCOCC3)C4=CC=CC=C4

InChI

InChI=1S/C23H22BrNO5/c1-14-20(26)18-12-17(24)13-19(22(18)30-21(14)16-6-4-3-5-7-16)23(27)29-15(2)25-8-10-28-11-9-25/h3-7,12-13,15H,8-11H2,1-2H3