2-nitro-N-pentyl-4-piperidin-1-ylsulfonyl-aniline

Systemtic Name: 2-nitro-N-pentyl-4-piperidin-1-ylsulfonyl-aniline Openeye Name: 2-nitro-N-pentyl-4-(1-piperidylsulfonyl)aniline CAS Name: 2-nitro-N-pentyl-4-(1-piperidinylsulfonyl)aniline IUPAC Name: 2-nitro-N-pentyl-4-piperidin-1-ylsulfonylaniline Traditional Name: amyl-(2-nitro-4-piperidinosulfonyl-phenyl)amine Formula: C16H25N3O4S MolecularWeight: 355.4524

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)[N+](=O)[O-]

Isomeric SMILES

CCCCCNC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)[N+](=O)[O-]

InChI

InChI=1S/C16H25N3O4S/c1-2-3-5-10-17-15-9-8-14(13-16(15)19(20)21)24(22,23)18-11-6-4-7-12-18/h8-9,13,17H,2-7,10-12H2,1H3