1-butyl-N-[4-(3-methylbutylsulfinyl)-3-nitro-phenyl]cyclopropane-1-carboxamide

Systemtic Name: 1-butyl-N-[4-(3-methylbutylsulfinyl)-3-nitro-phenyl]cyclopropane-1-carboxamide Openeye Name: 1-butyl-N-(4-isopentylsulfinyl-3-nitro-phenyl)cyclopropanecarboxamide CAS Name: 1-butyl-N-[4-(3-methylbutylsulfinyl)-3-nitrophenyl]-1-cyclopropanecarboxamide IUPAC Name: 1-butyl-N-[4-(3-methylbutylsulfinyl)-3-nitrophenyl]cyclopropane-1-carboxamide Traditional Name: 1-butyl-N-(4-isoamylsulfinyl-3-nitro-phenyl)cyclopropanecarboxamide Formula: C19H28N2O4S MolecularWeight: 380.50162

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(CC1)C(=O)NC2=CC(=C(C=C2)S(=O)CCC(C)C)[N+](=O)[O-]

Isomeric SMILES

CCCCC1(CC1)C(=O)NC2=CC(=C(C=C2)S(=O)CCC(C)C)[N+](=O)[O-]

InChI

InChI=1S/C19H28N2O4S/c1-4-5-9-19(10-11-19)18(22)20-15-6-7-17(16(13-15)21(23)24)26(25)12-8-14(2)3/h6-7,13-14H,4-5,8-12H2,1-3H3,(H,20,22)