3,4,5-trimethoxy-N-(2-nitro-4-piperidin-1-ylsulfonyl-phenyl)aniline

Systemtic Name: 3,4,5-trimethoxy-N-(2-nitro-4-piperidin-1-ylsulfonyl-phenyl)aniline Openeye Name: 3,4,5-trimethoxy-N-[2-nitro-4-(1-piperidylsulfonyl)phenyl]aniline CAS Name: 3,4,5-trimethoxy-N-[2-nitro-4-(1-piperidinylsulfonyl)phenyl]aniline IUPAC Name: 3,4,5-trimethoxy-N-(2-nitro-4-piperidin-1-ylsulfonylphenyl)aniline Traditional Name: (2-nitro-4-piperidinosulfonyl-phenyl)-(3,4,5-trimethoxyphenyl)amine Formula: C20H25N3O7S MolecularWeight: 451.4934

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)NC2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)NC2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)[N+](=O)[O-]

InChI

InChI=1S/C20H25N3O7S/c1-28-18-11-14(12-19(29-2)20(18)30-3)21-16-8-7-15(13-17(16)23(24)25)31(26,27)22-9-5-4-6-10-22/h7-8,11-13,21H,4-6,9-10H2,1-3H3