5-(4-methylsulfonylpiperazin-1-yl)-2-nitro-N-prop-2-enyl-aniline

Systemtic Name: 5-(4-methylsulfonylpiperazin-1-yl)-2-nitro-N-prop-2-enyl-aniline Openeye Name: N-allyl-5-(4-methylsulfonylpiperazin-1-yl)-2-nitro-aniline CAS Name: 5-(4-methylsulfonyl-1-piperazinyl)-2-nitro-N-prop-2-enylaniline IUPAC Name: 5-(4-methylsulfonylpiperazin-1-yl)-2-nitro-N-prop-2-enylaniline Traditional Name: allyl-[5-(4-mesylpiperazino)-2-nitro-phenyl]amine Formula: C14H20N4O4S MolecularWeight: 340.398

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCN(CC1)C2=CC(=C(C=C2)[N+](=O)[O-])NCC=C

Isomeric SMILES

CS(=O)(=O)N1CCN(CC1)C2=CC(=C(C=C2)[N+](=O)[O-])NCC=C

InChI

InChI=1S/C14H20N4O4S/c1-3-6-15-13-11-12(4-5-14(13)18(19)20)16-7-9-17(10-8-16)23(2,21)22/h3-5,11,15H,1,6-10H2,2H3