ethyl 2-azanyl-4-[5-[(4-bromanylphenoxy)methyl]furan-2-yl]-5-oxidanylidene-4,6,7,8-tetrahydrochromene-3-carboxylate

Systemtic Name: ethyl 2-azanyl-4-[5-[(4-bromanylphenoxy)methyl]furan-2-yl]-5-oxidanylidene-4,6,7,8-tetrahydrochromene-3-carboxylate Openeye Name: ethyl 2-amino-4-[5-[(4-bromophenoxy)methyl]-2-furyl]-5-oxo-4,6,7,8-tetrahydrochromene-3-carboxylate CAS Name: 2-amino-4-[5-[(4-bromophenoxy)methyl]-2-furanyl]-5-oxo-4,6,7,8-tetrahydro-1-benzopyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-amino-4-[5-[(4-bromophenoxy)methyl]furan-2-yl]-5-oxo-4,6,7,8-tetrahydrochromene-3-carboxylate Traditional Name: 2-amino-4-[5-[(4-bromophenoxy)methyl]-2-furyl]-5-keto-4,6,7,8-tetrahydrochromene-3-carboxylic acid ethyl ester Formula: C23H22BrNO6 MolecularWeight: 488.32788

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=C(C1C3=CC=C(O3)COC4=CC=C(C=C4)Br)C(=O)CCC2)N

Isomeric SMILES

CCOC(=O)C1=C(OC2=C(C1C3=CC=C(O3)COC4=CC=C(C=C4)Br)C(=O)CCC2)N

InChI

InChI=1S/C23H22BrNO6/c1-2-28-23(27)21-20(19-16(26)4-3-5-17(19)31-22(21)25)18-11-10-15(30-18)12-29-14-8-6-13(24)7-9-14/h6-11,20H,2-5,12,25H2,1H3