2-(4-naphtho[3,2-b][1]benzothiol-11-ylphenoxy)-3-phenyl-propanoic acid

Systemtic Name: 2-(4-naphtho[3,2-b][1]benzothiol-11-ylphenoxy)-3-phenyl-propanoic acid Openeye Name: 2-(4-naphtho[3,2-b]benzothiophen-11-ylphenoxy)-3-phenyl-propanoic acid CAS Name: 2-[4-(11-naphtho[3,2-b][1]benzothiolyl)phenoxy]-3-phenylpropanoic acid IUPAC Name: 2-(4-naphtho[3,2-b][1]benzothiol-11-ylphenoxy)-3-phenylpropanoic acid Traditional Name: 2-(4-naphtho[3,2-b]benzothiophen-11-ylphenoxy)-3-phenyl-propionic acid Formula: C31H22O3S MolecularWeight: 474.56958

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)O)OC2=CC=C(C=C2)C3=C4C5=CC=CC=C5SC4=CC6=CC=CC=C63

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)O)OC2=CC=C(C=C2)C3=C4C5=CC=CC=C5SC4=CC6=CC=CC=C63

InChI

InChI=1S/C31H22O3S/c32-31(33)26(18-20-8-2-1-3-9-20)34-23-16-14-21(15-17-23)29-24-11-5-4-10-22(24)19-28-30(29)25-12-6-7-13-27(25)35-28/h1-17,19,26H,18H2,(H,32,33)