4-[methyl-[(4-prop-2-enoxyphenyl)methyl]amino]-3-nitro-benzenesulfonamide

Systemtic Name: 4-[methyl-[(4-prop-2-enoxyphenyl)methyl]amino]-3-nitro-benzenesulfonamide Openeye Name: 4-[(4-allyloxyphenyl)methyl-methyl-amino]-3-nitro-benzenesulfonamide CAS Name: 4-[methyl-[(4-prop-2-enoxyphenyl)methyl]amino]-3-nitrobenzenesulfonamide IUPAC Name: 4-[methyl-[(4-prop-2-enoxyphenyl)methyl]amino]-3-nitrobenzenesulfonamide Traditional Name: 4-[(4-allyloxybenzyl)-methyl-amino]-3-nitro-benzenesulfonamide Formula: C17H19N3O5S MolecularWeight: 377.41486

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)OCC=C)C2=C(C=C(C=C2)S(=O)(=O)N)[N+](=O)[O-]

Isomeric SMILES

CN(CC1=CC=C(C=C1)OCC=C)C2=C(C=C(C=C2)S(=O)(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C17H19N3O5S/c1-3-10-25-14-6-4-13(5-7-14)12-19(2)16-9-8-15(26(18,23)24)11-17(16)20(21)22/h3-9,11H,1,10,12H2,2H3,(H2,18,23,24)