2,4-bis(1-ethyl-2-methyl-indol-3-yl)-4-oxidanylidene-butanoic acid

Systemtic Name: 2,4-bis(1-ethyl-2-methyl-indol-3-yl)-4-oxidanylidene-butanoic acid Openeye Name: 2,4-bis(1-ethyl-2-methyl-indol-3-yl)-4-oxo-butanoic acid CAS Name: 2,4-bis(1-ethyl-2-methyl-3-indolyl)-4-oxobutanoic acid IUPAC Name: 2,4-bis(1-ethyl-2-methylindol-3-yl)-4-oxobutanoic acid Traditional Name: 2,4-bis(1-ethyl-2-methyl-indol-3-yl)-4-keto-butyric acid Formula: C26H28N2O3 MolecularWeight: 416.51212

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C2=CC=CC=C21)C(CC(=O)C3=C(N(C4=CC=CC=C43)CC)C)C(=O)O)C

Isomeric SMILES

CCN1C(=C(C2=CC=CC=C21)C(CC(=O)C3=C(N(C4=CC=CC=C43)CC)C)C(=O)O)C

InChI

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