ethyl 3-[2-(phenylsulfonyl)hydrazinyl]propanoate; 4-methylbenzenesulfonic acid

Systemtic Name: ethyl 3-[2-(phenylsulfonyl)hydrazinyl]propanoate; 4-methylbenzenesulfonic acid Openeye Name: ethyl 3-[2-(benzenesulfonyl)hydrazino]propanoate; 4-methylbenzenesulfonic acid CAS Name: 3-(benzenesulfonylhydrazo)propanoic acid ethyl ester; 4-methylbenzenesulfonic acid IUPAC Name: ethyl 3-[2-(benzenesulfonyl)hydrazinyl]propanoate; 4-methylbenzenesulfonic acid Traditional Name: 3-(N'-besylhydrazino)propionic acid ethyl ester; tosylic acid Formula: C18H24N2O7S2 MolecularWeight: 444.52236

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCNNS(=O)(=O)C1=CC=CC=C1.CC1=CC=C(C=C1)S(=O)(=O)O

Isomeric SMILES

CCOC(=O)CCNNS(=O)(=O)C1=CC=CC=C1.CC1=CC=C(C=C1)S(=O)(=O)O

InChI

InChI=1S/C11H16N2O4S.C7H8O3S/c1-2-17-11(14)8-9-12-13-18(15,16)10-6-4-3-5-7-10;1-6-2-4-7(5-3-6)11(8,9)10/h3-7,12-13H,2,8-9H2,1H3;2-5H,1H3,(H,8,9,10)