dimethyl 2-[[2,2-bis(phenylsulfonyl)cyclopropyl]-(4-nitrophenyl)methylidene]propanedioate

Systemtic Name: dimethyl 2-[[2,2-bis(phenylsulfonyl)cyclopropyl]-(4-nitrophenyl)methylidene]propanedioate Openeye Name: dimethyl 2-[[2,2-bis(benzenesulfonyl)cyclopropyl]-(4-nitrophenyl)methylene]propanedioate CAS Name: 2-[[2,2-bis(benzenesulfonyl)cyclopropyl]-(4-nitrophenyl)methylidene]propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[[2,2-bis(benzenesulfonyl)cyclopropyl]-(4-nitrophenyl)methylidene]propanedioate Traditional Name: 2-[(2,2-dibesylcyclopropyl)-(4-nitrophenyl)methylene]malonic acid dimethyl ester Formula: C27H23NO10S2 MolecularWeight: 585.60222

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=C(C1CC1(S(=O)(=O)C2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3)C4=CC=C(C=C4)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

COC(=O)C(=C(C1CC1(S(=O)(=O)C2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3)C4=CC=C(C=C4)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C27H23NO10S2/c1-37-25(29)24(26(30)38-2)23(18-13-15-19(16-14-18)28(31)32)22-17-27(22,39(33,34)20-9-5-3-6-10-20)40(35,36)21-11-7-4-8-12-21/h3-16,22H,17H2,1-2H3