methyl 2-[2-[(1-oxidanylidene-3-phenyl-1-phenylmethoxy-propan-2-yl)carbamoyl]pyrrolidin-1-yl]sulfonylbenzoate

Systemtic Name: methyl 2-[2-[(1-oxidanylidene-3-phenyl-1-phenylmethoxy-propan-2-yl)carbamoyl]pyrrolidin-1-yl]sulfonylbenzoate Openeye Name: methyl 2-[2-[(1-benzyl-2-benzyloxy-2-oxo-ethyl)carbamoyl]pyrrolidin-1-yl]sulfonylbenzoate CAS Name: 2-[[2-[oxo-[(1-oxo-3-phenyl-1-phenylmethoxypropan-2-yl)amino]methyl]-1-pyrrolidinyl]sulfonyl]benzoic acid methyl ester IUPAC Name: methyl 2-[2-[(1-oxo-3-phenyl-1-phenylmethoxypropan-2-yl)carbamoyl]pyrrolidin-1-yl]sulfonylbenzoate Traditional Name: 2-[2-[(2-benzoxy-1-benzyl-2-keto-ethyl)carbamoyl]pyrrolidino]sulfonylbenzoic acid methyl ester Formula: C29H30N2O7S MolecularWeight: 550.6227

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1S(=O)(=O)N2CCCC2C(=O)NC(CC3=CC=CC=C3)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC=CC=C1S(=O)(=O)N2CCCC2C(=O)NC(CC3=CC=CC=C3)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C29H30N2O7S/c1-37-28(33)23-15-8-9-17-26(23)39(35,36)31-18-10-16-25(31)27(32)30-24(19-21-11-4-2-5-12-21)29(34)38-20-22-13-6-3-7-14-22/h2-9,11-15,17,24-25H,10,16,18-20H2,1H3,(H,30,32)