2-[2-methyl-3-[[2-methyl-4-(1-oxidanyl-1-oxidanylidene-propan-2-yl)-1H-indol-3-yl]-phenyl-methyl]-1H-indol-4-yl]propanoic acid

Systemtic Name: 2-[2-methyl-3-[[2-methyl-4-(1-oxidanyl-1-oxidanylidene-propan-2-yl)-1H-indol-3-yl]-phenyl-methyl]-1H-indol-4-yl]propanoic acid Openeye Name: 2-[3-[[4-(2-hydroxy-1-methyl-2-oxo-ethyl)-2-methyl-1H-indol-3-yl]-phenyl-methyl]-2-methyl-1H-indol-4-yl]propanoic acid CAS Name: 2-[3-[[4-(1-hydroxy-1-oxopropan-2-yl)-2-methyl-1H-indol-3-yl]-phenylmethyl]-2-methyl-1H-indol-4-yl]propanoic acid IUPAC Name: 2-[3-[[4-(1-hydroxy-1-oxopropan-2-yl)-2-methyl-1H-indol-3-yl]-phenylmethyl]-2-methyl-1H-indol-4-yl]propanoic acid Traditional Name: 2-[3-[[4-(2-hydroxy-2-keto-1-methyl-ethyl)-2-methyl-1H-indol-3-yl]-phenyl-methyl]-2-methyl-1H-indol-4-yl]propionic acid Formula: C31H30N2O4 MolecularWeight: 494.5809

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=CC=C2N1)C(C)C(=O)O)C(C3=CC=CC=C3)C4=C(NC5=CC=CC(=C54)C(C)C(=O)O)C

Isomeric SMILES

CC1=C(C2=C(C=CC=C2N1)C(C)C(=O)O)C(C3=CC=CC=C3)C4=C(NC5=CC=CC(=C54)C(C)C(=O)O)C

InChI

InChI=1S/C31H30N2O4/c1-16(30(34)35)21-12-8-14-23-28(21)25(18(3)32-23)27(20-10-6-5-7-11-20)26-19(4)33-24-15-9-13-22(29(24)26)17(2)31(36)37/h5-17,27,32-33H,1-4H3,(H,34,35)(H,36,37)