O1-[(1S,2R,3S,4R)-2-[(3,5-dimethylphenyl)-(phenylsulfonyl)amino]-4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl] O2,O2'-diethyl 3-cyanoaziridine-1,2,2-tricarboxylate

Systemtic Name: O1-[(1S,2R,3S,4R)-2-[(3,5-dimethylphenyl)-(phenylsulfonyl)amino]-4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl] O2,O2'-diethyl 3-cyanoaziridine-1,2,2-tricarboxylate Openeye Name: O1-[(1R,2S,3R,4S)-3-[N-(benzenesulfonyl)-3,5-dimethyl-anilino]-1,7,7-trimethyl-norbornan-2-yl] O2,O2'-diethyl 3-cyanoaziridine-1,2,2-tricarboxylate CAS Name: 3-cyanoaziridine-1,2,2-tricarboxylic acid O1-[(1S,2R,3S,4R)-2-[N-(benzenesulfonyl)-3,5-dimethylanilino]-4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl] ester O2,O2'-diethyl ester IUPAC Name: 1-O-[(1S,2R,3S,4R)-2-[N-(benzenesulfonyl)-3,5-dimethylanilino]-4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl] 2-O,2-O'-diethyl 3-cyanoaziridine-1,2,2-tricarboxylate Traditional Name: 3-cyanoethylenimine-1,2,2-tricarboxylic acid O1-[(1R,2S,3R,4S)-3-(N-besyl-3,5-dimethyl-anilino)-1,7,7-trimethyl-norbornan-2-yl] ester O2,O2'-diethyl ester Formula: C34H41N3O8S MolecularWeight: 651.76964

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(C(N1C(=O)OC2C(C3CCC2(C3(C)C)C)N(C4=CC(=CC(=C4)C)C)S(=O)(=O)C5=CC=CC=C5)C#N)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1(C(N1C(=O)O[C@@H]2[C@@H]([C@H]3CC[C@@]2(C3(C)C)C)N(C4=CC(=CC(=C4)C)C)S(=O)(=O)C5=CC=CC=C5)C#N)C(=O)OCC

InChI

InChI=1S/C34H41N3O8S/c1-8-43-29(38)34(30(39)44-9-2)26(20-35)36(34)31(40)45-28-27(25-15-16-33(28,7)32(25,5)6)37(23-18-21(3)17-22(4)19-23)46(41,42)24-13-11-10-12-14-24/h10-14,17-19,25-28H,8-9,15-16H2,1-7H3/t25-,26?,27-,28-,33+,36?/m1/s1