2-[5-(4-ethanoylphenyl)-1-(phenylmethyl)indol-3-yl]-2-oxidanylidene-ethanoic acid

Systemtic Name: 2-[5-(4-ethanoylphenyl)-1-(phenylmethyl)indol-3-yl]-2-oxidanylidene-ethanoic acid Openeye Name: 2-[5-(4-acetylphenyl)-1-benzyl-indol-3-yl]-2-oxo-acetic acid CAS Name: 2-[5-(4-acetylphenyl)-1-(phenylmethyl)-3-indolyl]-2-oxoacetic acid IUPAC Name: 2-[5-(4-acetylphenyl)-1-benzylindol-3-yl]-2-oxoacetic acid Traditional Name: 2-[5-(4-acetylphenyl)-1-benzyl-indol-3-yl]-2-keto-acetic acid Formula: C25H19NO4 MolecularWeight: 397.42266

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)C2=CC3=C(C=C2)N(C=C3C(=O)C(=O)O)CC4=CC=CC=C4

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)C2=CC3=C(C=C2)N(C=C3C(=O)C(=O)O)CC4=CC=CC=C4

InChI

InChI=1S/C25H19NO4/c1-16(27)18-7-9-19(10-8-18)20-11-12-23-21(13-20)22(24(28)25(29)30)15-26(23)14-17-5-3-2-4-6-17/h2-13,15H,14H2,1H3,(H,29,30)