[(2,3-diphenylcyclopropyl)-phenylsulfanyl-methyl] benzoate

Systemtic Name: [(2,3-diphenylcyclopropyl)-phenylsulfanyl-methyl] benzoate Openeye Name: [(2,3-diphenylcyclopropyl)-phenylsulfanyl-methyl] benzoate CAS Name: benzoic acid [(2,3-diphenylcyclopropyl)-(phenylthio)methyl] ester IUPAC Name: [(2,3-diphenylcyclopropyl)-phenylsulfanylmethyl] benzoate Traditional Name: benzoic acid [(2,3-diphenylcyclopropyl)-(phenylthio)methyl] ester Formula: C29H24O2S MolecularWeight: 436.56466

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2C(C2C(OC(=O)C3=CC=CC=C3)SC4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2C(C2C(OC(=O)C3=CC=CC=C3)SC4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H24O2S/c30-28(23-17-9-3-10-18-23)31-29(32-24-19-11-4-12-20-24)27-25(21-13-5-1-6-14-21)26(27)22-15-7-2-8-16-22/h1-20,25-27,29H