2-[1-methylsulfanyl-9-(phenylmethyl)carbazol-2-yl]ethanoic acid

Systemtic Name: 2-[1-methylsulfanyl-9-(phenylmethyl)carbazol-2-yl]ethanoic acid Openeye Name: 2-(9-benzyl-1-methylsulfanyl-carbazol-2-yl)acetic acid CAS Name: 2-[1-(methylthio)-9-(phenylmethyl)-2-carbazolyl]acetic acid IUPAC Name: 2-(9-benzyl-1-methylsulfanylcarbazol-2-yl)acetic acid Traditional Name: 2-[9-benzyl-1-(methylthio)carbazol-2-yl]acetic acid Formula: C22H19NO2S MolecularWeight: 361.45676

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=CC2=C1N(C3=CC=CC=C23)CC4=CC=CC=C4)CC(=O)O

Isomeric SMILES

CSC1=C(C=CC2=C1N(C3=CC=CC=C23)CC4=CC=CC=C4)CC(=O)O

InChI

InChI=1S/C22H19NO2S/c1-26-22-16(13-20(24)25)11-12-18-17-9-5-6-10-19(17)23(21(18)22)14-15-7-3-2-4-8-15/h2-12H,13-14H2,1H3,(H,24,25)