methyl 3-[[1-(diphenylmethyl)azetidin-3-yl]-methylsulfonyl-methyl]benzoate

Systemtic Name: methyl 3-[[1-(diphenylmethyl)azetidin-3-yl]-methylsulfonyl-methyl]benzoate Openeye Name: methyl 3-[(1-benzhydrylazetidin-3-yl)-methylsulfonyl-methyl]benzoate CAS Name: 3-[[1-(diphenylmethyl)-3-azetidinyl]-methylsulfonylmethyl]benzoic acid methyl ester IUPAC Name: methyl 3-[(1-benzhydrylazetidin-3-yl)-methylsulfonylmethyl]benzoate Traditional Name: 3-[(1-benzhydrylazetidin-3-yl)-mesyl-methyl]benzoic acid methyl ester Formula: C26H27NO4S MolecularWeight: 449.56188

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)C(C2CN(C2)C(C3=CC=CC=C3)C4=CC=CC=C4)S(=O)(=O)C

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)C(C2CN(C2)C(C3=CC=CC=C3)C4=CC=CC=C4)S(=O)(=O)C

InChI

InChI=1S/C26H27NO4S/c1-31-26(28)22-15-9-14-21(16-22)25(32(2,29)30)23-17-27(18-23)24(19-10-5-3-6-11-19)20-12-7-4-8-13-20/h3-16,23-25H,17-18H2,1-2H3