2,2-dimethyl-3-(2-methylprop-1-enyl)-N-[2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethyl]cyclopropane-1-carboxamide

Systemtic Name: 2,2-dimethyl-3-(2-methylprop-1-enyl)-N-[2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethyl]cyclopropane-1-carboxamide Openeye Name: 2,2-dimethyl-3-(2-methylprop-1-enyl)-N-[2-(4-methylsulfonyl-2-nitro-anilino)ethyl]cyclopropanecarboxamide CAS Name: 2,2-dimethyl-3-(2-methylprop-1-enyl)-N-[2-(4-methylsulfonyl-2-nitroanilino)ethyl]-1-cyclopropanecarboxamide IUPAC Name: 2,2-dimethyl-3-(2-methylprop-1-enyl)-N-[2-(4-methylsulfonyl-2-nitroanilino)ethyl]cyclopropane-1-carboxamide Traditional Name: N-[2-(4-mesyl-2-nitro-anilino)ethyl]-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarboxamide Formula: C19H27N3O5S MolecularWeight: 409.49978

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1C(C1(C)C)C(=O)NCCNC2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-])C

Isomeric SMILES

CC(=CC1C(C1(C)C)C(=O)NCCNC2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-])C

InChI

InChI=1S/C19H27N3O5S/c1-12(2)10-14-17(19(14,3)4)18(23)21-9-8-20-15-7-6-13(28(5,26)27)11-16(15)22(24)25/h6-7,10-11,14,17,20H,8-9H2,1-5H3,(H,21,23)