ethyl 3-(4-bromophenyl)-8-[(4-methylpiperazin-1-yl)methyl]-7-oxidanyl-4-oxidanylidene-chromene-2-carboxylate

Systemtic Name: ethyl 3-(4-bromophenyl)-8-[(4-methylpiperazin-1-yl)methyl]-7-oxidanyl-4-oxidanylidene-chromene-2-carboxylate Openeye Name: ethyl 3-(4-bromophenyl)-7-hydroxy-8-[(4-methylpiperazin-1-yl)methyl]-4-oxo-chromene-2-carboxylate CAS Name: 3-(4-bromophenyl)-7-hydroxy-8-[(4-methyl-1-piperazinyl)methyl]-4-oxo-1-benzopyran-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-(4-bromophenyl)-7-hydroxy-8-[(4-methylpiperazin-1-yl)methyl]-4-oxochromene-2-carboxylate Traditional Name: 3-(4-bromophenyl)-7-hydroxy-4-keto-8-[(4-methylpiperazino)methyl]chromene-2-carboxylic acid ethyl ester Formula: C24H25BrN2O5 MolecularWeight: 501.3697

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=O)C2=C(O1)C(=C(C=C2)O)CN3CCN(CC3)C)C4=CC=C(C=C4)Br

Isomeric SMILES

CCOC(=O)C1=C(C(=O)C2=C(O1)C(=C(C=C2)O)CN3CCN(CC3)C)C4=CC=C(C=C4)Br

InChI

InChI=1S/C24H25BrN2O5/c1-3-31-24(30)23-20(15-4-6-16(25)7-5-15)21(29)17-8-9-19(28)18(22(17)32-23)14-27-12-10-26(2)11-13-27/h4-9,28H,3,10-14H2,1-2H3