2-[2-[(2-oxidanyl-4-oxidanylidene-chromen-3-yl)-phenyl-methyl]-1H-indol-3-yl]ethyl benzoate

Systemtic Name: 2-[2-[(2-oxidanyl-4-oxidanylidene-chromen-3-yl)-phenyl-methyl]-1H-indol-3-yl]ethyl benzoate Openeye Name: 2-[2-[(2-hydroxy-4-oxo-chromen-3-yl)-phenyl-methyl]-1H-indol-3-yl]ethyl benzoate CAS Name: benzoic acid 2-[2-[(2-hydroxy-4-oxo-1-benzopyran-3-yl)-phenylmethyl]-1H-indol-3-yl]ethyl ester IUPAC Name: 2-[2-[(2-hydroxy-4-oxochromen-3-yl)-phenylmethyl]-1H-indol-3-yl]ethyl benzoate Traditional Name: benzoic acid 2-[2-[(2-hydroxy-4-keto-chromen-3-yl)-phenyl-methyl]-1H-indol-3-yl]ethyl ester Formula: C33H25NO5 MolecularWeight: 515.5553

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=C(OC3=CC=CC=C3C2=O)O)C4=C(C5=CC=CC=C5N4)CCOC(=O)C6=CC=CC=C6

Isomeric SMILES

C1=CC=C(C=C1)C(C2=C(OC3=CC=CC=C3C2=O)O)C4=C(C5=CC=CC=C5N4)CCOC(=O)C6=CC=CC=C6

InChI

InChI=1S/C33H25NO5/c35-31-25-16-8-10-18-27(25)39-33(37)29(31)28(21-11-3-1-4-12-21)30-24(23-15-7-9-17-26(23)34-30)19-20-38-32(36)22-13-5-2-6-14-22/h1-18,28,34,37H,19-20H2