2-nitro-4-piperidin-1-ylsulfonyl-N-(2,4,4-trimethylpentan-2-yl)aniline

Systemtic Name: 2-nitro-4-piperidin-1-ylsulfonyl-N-(2,4,4-trimethylpentan-2-yl)aniline Openeye Name: 2-nitro-4-(1-piperidylsulfonyl)-N-(1,1,3,3-tetramethylbutyl)aniline CAS Name: 2-nitro-4-(1-piperidinylsulfonyl)-N-(2,4,4-trimethylpentan-2-yl)aniline IUPAC Name: 2-nitro-4-piperidin-1-ylsulfonyl-N-(2,4,4-trimethylpentan-2-yl)aniline Traditional Name: (2-nitro-4-piperidinosulfonyl-phenyl)-(1,1,3,3-tetramethylbutyl)amine Formula: C19H31N3O4S MolecularWeight: 397.53214

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(C)(C)NC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)CC(C)(C)NC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)[N+](=O)[O-]

InChI

InChI=1S/C19H31N3O4S/c1-18(2,3)14-19(4,5)20-16-10-9-15(13-17(16)22(23)24)27(25,26)21-11-7-6-8-12-21/h9-10,13,20H,6-8,11-12,14H2,1-5H3