2-(6-chloranyl-1H-indol-3-yl)-3-oxidanylidene-3-(3-phenylmethoxyphenyl)propanoic acid

Systemtic Name: 2-(6-chloranyl-1H-indol-3-yl)-3-oxidanylidene-3-(3-phenylmethoxyphenyl)propanoic acid Openeye Name: 3-(3-benzyloxyphenyl)-2-(6-chloro-1H-indol-3-yl)-3-oxo-propanoic acid CAS Name: 2-(6-chloro-1H-indol-3-yl)-3-oxo-3-(3-phenylmethoxyphenyl)propanoic acid IUPAC Name: 2-(6-chloro-1H-indol-3-yl)-3-oxo-3-(3-phenylmethoxyphenyl)propanoic acid Traditional Name: 3-(3-benzoxyphenyl)-2-(6-chloro-1H-indol-3-yl)-3-keto-propionic acid Formula: C24H18ClNO4 MolecularWeight: 419.85702

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=CC(=C2)C(=O)C(C3=CNC4=C3C=CC(=C4)Cl)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=CC(=C2)C(=O)C(C3=CNC4=C3C=CC(=C4)Cl)C(=O)O

InChI

InChI=1S/C24H18ClNO4/c25-17-9-10-19-20(13-26-21(19)12-17)22(24(28)29)23(27)16-7-4-8-18(11-16)30-14-15-5-2-1-3-6-15/h1-13,22,26H,14H2,(H,28,29)