2-(1H-indol-4-yl)-2-methyl-3-[4-[(7-methyl-2,3-dihydro-1-benzofuran-3-yl)methoxy]phenyl]-3-oxidanylidene-propanoic acid

Systemtic Name: 2-(1H-indol-4-yl)-2-methyl-3-[4-[(7-methyl-2,3-dihydro-1-benzofuran-3-yl)methoxy]phenyl]-3-oxidanylidene-propanoic acid Openeye Name: 2-(1H-indol-4-yl)-2-methyl-3-[4-[(7-methyl-2,3-dihydrobenzofuran-3-yl)methoxy]phenyl]-3-oxo-propanoic acid CAS Name: 2-(1H-indol-4-yl)-2-methyl-3-[4-[(7-methyl-2,3-dihydrobenzofuran-3-yl)methoxy]phenyl]-3-oxopropanoic acid IUPAC Name: 2-(1H-indol-4-yl)-2-methyl-3-[4-[(7-methyl-2,3-dihydro-1-benzofuran-3-yl)methoxy]phenyl]-3-oxopropanoic acid Traditional Name: 2-(1H-indol-4-yl)-3-keto-2-methyl-3-[4-[(7-methylcoumaran-3-yl)methoxy]phenyl]propionic acid Formula: C28H25NO5 MolecularWeight: 455.5018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1OCC2COC3=CC=C(C=C3)C(=O)C(C)(C4=C5C=CNC5=CC=C4)C(=O)O

Isomeric SMILES

CC1=CC=CC2=C1OCC2COC3=CC=C(C=C3)C(=O)C(C)(C4=C5C=CNC5=CC=C4)C(=O)O

InChI

InChI=1S/C28H25NO5/c1-17-5-3-6-21-19(16-34-25(17)21)15-33-20-11-9-18(10-12-20)26(30)28(2,27(31)32)23-7-4-8-24-22(23)13-14-29-24/h3-14,19,29H,15-16H2,1-2H3,(H,31,32)