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4-oxidanylidene-2,4-bis(2,5,6-trimethyl-1H-indol-3-yl)butanoic acid

4-oxidanylidene-2,4-bis(2,5,6-trimethyl-1H-indol-3-yl)butanoic acid

Systemtic Name:4-oxidanylidene-2,4-bis(2,5,6-trimethyl-1H-indol-3-yl)butanoic acid
Openeye Name:4-oxo-2,4-bis(2,5,6-trimethyl-1H-indol-3-yl)butanoic acid
CAS Name:4-oxo-2,4-bis(2,5,6-trimethyl-1H-indol-3-yl)butanoic acid
IUPAC Name:4-oxo-2,4-bis(2,5,6-trimethyl-1H-indol-3-yl)butanoic acid
Traditional Name:4-keto-2,4-bis(2,5,6-trimethyl-1H-indol-3-yl)butyric acid
Formula: C26H28N2O3
MolecularWeight: 416.51212
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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=C(N2)C)C(CC(=O)C3=C(NC4=CC(=C(C=C43)C)C)C)C(=O)O)C


Isomeric SMILES

CC1=C(C=C2C(=C1)C(=C(N2)C)C(CC(=O)C3=C(NC4=CC(=C(C=C43)C)C)C)C(=O)O)C


InChI

InChI=1S/C26H28N2O3/c1-12-7-18-21(9-14(12)3)27-16(5)24(18)20(26(30)31)11-23(29)25-17(6)28-22-10-15(4)13(2)8-19(22)25/h7-10,20,27-28H,11H2,1-6H3,(H,30,31)


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