2-[11-(4-hydroxyphenyl)naphtho[2,3-b][1]benzothiol-3-yl]oxyethanoic acid

Systemtic Name: 2-[11-(4-hydroxyphenyl)naphtho[2,3-b][1]benzothiol-3-yl]oxyethanoic acid Openeye Name: 2-[11-(4-hydroxyphenyl)naphtho[2,3-b]benzothiophen-3-yl]oxyacetic acid CAS Name: 2-[[11-(4-hydroxyphenyl)-3-naphtho[2,3-b][1]benzothiolyl]oxy]acetic acid IUPAC Name: 2-[11-(4-hydroxyphenyl)naphtho[2,3-b][1]benzothiol-3-yl]oxyacetic acid Traditional Name: 2-[11-(4-hydroxyphenyl)naphtho[2,3-b]benzothiophen-3-yl]oxyacetic acid Formula: C24H16O4S MolecularWeight: 400.44644

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C3C(=C2C4=CC=C(C=C4)O)C5=C(S3)C=C(C=C5)OCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=C3C(=C2C4=CC=C(C=C4)O)C5=C(S3)C=C(C=C5)OCC(=O)O

InChI

InChI=1S/C24H16O4S/c25-16-7-5-14(6-8-16)23-18-4-2-1-3-15(18)11-21-24(23)19-10-9-17(12-20(19)29-21)28-13-22(26)27/h1-12,25H,13H2,(H,26,27)