tert-butyl 3-[(2-ethoxy-2-oxidanylidene-ethyl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]-4-(phenylsulfonyl)pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 3-[(2-ethoxy-2-oxidanylidene-ethyl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]-4-(phenylsulfonyl)pyrrolidine-1-carboxylate Openeye Name: tert-butyl 3-(benzenesulfonyl)-4-[tert-butoxycarbonyl-(2-ethoxy-2-oxo-ethyl)amino]pyrrolidine-1-carboxylate CAS Name: 3-(benzenesulfonyl)-4-[(2-ethoxy-2-oxoethyl)-[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-(benzenesulfonyl)-4-[(2-ethoxy-2-oxoethyl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrrolidine-1-carboxylate Traditional Name: 3-besyl-4-[tert-butoxycarbonyl-(2-ethoxy-2-keto-ethyl)amino]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C24H36N2O8S MolecularWeight: 512.61624

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN(C1CN(CC1S(=O)(=O)C2=CC=CC=C2)C(=O)OC(C)(C)C)C(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)CN(C1CN(CC1S(=O)(=O)C2=CC=CC=C2)C(=O)OC(C)(C)C)C(=O)OC(C)(C)C

InChI

InChI=1S/C24H36N2O8S/c1-8-32-20(27)16-26(22(29)34-24(5,6)7)18-14-25(21(28)33-23(2,3)4)15-19(18)35(30,31)17-12-10-9-11-13-17/h9-13,18-19H,8,14-16H2,1-7H3