diethyl 5-bromanyl-2-oxidanylidene-3-[(3E)-2-oxidanylidene-3-(phenylmethylidene)pentyl]indole-1,3-dicarboxylate

Systemtic Name: diethyl 5-bromanyl-2-oxidanylidene-3-[(3E)-2-oxidanylidene-3-(phenylmethylidene)pentyl]indole-1,3-dicarboxylate Openeye Name: diethyl 3-[(3E)-3-benzylidene-2-oxo-pentyl]-5-bromo-2-oxo-indoline-1,3-dicarboxylate CAS Name: 5-bromo-2-oxo-3-[(3E)-2-oxo-3-(phenylmethylene)pentyl]indole-1,3-dicarboxylic acid diethyl ester IUPAC Name: diethyl 3-[(3E)-3-benzylidene-2-oxopentyl]-5-bromo-2-oxoindole-1,3-dicarboxylate Traditional Name: 5-bromo-3-[(E)-3-ethyl-2-keto-4-phenyl-but-3-enyl]-2-keto-indoline-1,3-dicarboxylic acid diethyl ester Formula: C26H26BrNO6 MolecularWeight: 528.39174

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=CC1=CC=CC=C1)C(=O)CC2(C3=C(C=CC(=C3)Br)N(C2=O)C(=O)OCC)C(=O)OCC

Isomeric SMILES

CC/C(=C\C1=CC=CC=C1)/C(=O)CC2(C3=C(C=CC(=C3)Br)N(C2=O)C(=O)OCC)C(=O)OCC

InChI

InChI=1S/C26H26BrNO6/c1-4-18(14-17-10-8-7-9-11-17)22(29)16-26(24(31)33-5-2)20-15-19(27)12-13-21(20)28(23(26)30)25(32)34-6-3/h7-15H,4-6,16H2,1-3H3/b18-14+