4-[ethanoyl(9H-thioxanthen-9-yl)amino]benzoic acid

Systemtic Name: 4-[ethanoyl(9H-thioxanthen-9-yl)amino]benzoic acid Openeye Name: 4-[acetyl(9H-thioxanthen-9-yl)amino]benzoic acid CAS Name: 4-[acetyl(9H-thioxanthen-9-yl)amino]benzoic acid IUPAC Name: 4-[acetyl(9H-thioxanthen-9-yl)amino]benzoic acid Traditional Name: 4-[acetyl(9H-thioxanthen-9-yl)amino]benzoic acid Formula: C22H17NO3S MolecularWeight: 375.44028

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C1C2=CC=CC=C2SC3=CC=CC=C13)C4=CC=C(C=C4)C(=O)O

Isomeric SMILES

CC(=O)N(C1C2=CC=CC=C2SC3=CC=CC=C13)C4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C22H17NO3S/c1-14(24)23(16-12-10-15(11-13-16)22(25)26)21-17-6-2-4-8-19(17)27-20-9-5-3-7-18(20)21/h2-13,21H,1H3,(H,25,26)