N-[(2R)-4-(furan-2-yl)butan-2-yl]-2-nitro-4-piperidin-1-ylsulfonyl-aniline

Systemtic Name: N-[(2R)-4-(furan-2-yl)butan-2-yl]-2-nitro-4-piperidin-1-ylsulfonyl-aniline Openeye Name: N-[(1R)-3-(2-furyl)-1-methyl-propyl]-2-nitro-4-(1-piperidylsulfonyl)aniline CAS Name: N-[(2R)-4-(2-furanyl)butan-2-yl]-2-nitro-4-(1-piperidinylsulfonyl)aniline IUPAC Name: N-[(2R)-4-(furan-2-yl)butan-2-yl]-2-nitro-4-piperidin-1-ylsulfonylaniline Traditional Name: [(1R)-3-(2-furyl)-1-methyl-propyl]-(2-nitro-4-piperidinosulfonyl-phenyl)amine Formula: C19H25N3O5S MolecularWeight: 407.4839

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CO1)NC2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)[N+](=O)[O-]

Isomeric SMILES

C[C@H](CCC1=CC=CO1)NC2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)[N+](=O)[O-]

InChI

InChI=1S/C19H25N3O5S/c1-15(7-8-16-6-5-13-27-16)20-18-10-9-17(14-19(18)22(23)24)28(25,26)21-11-3-2-4-12-21/h5-6,9-10,13-15,20H,2-4,7-8,11-12H2,1H3/t15-/m1/s1