1-[(2-acetamidophenyl)-[2-(oxidanylamino)-2-oxidanylidene-ethyl]amino]decane-4-sulfinic acid

Systemtic Name: 1-[(2-acetamidophenyl)-[2-(oxidanylamino)-2-oxidanylidene-ethyl]amino]decane-4-sulfinic acid Openeye Name: 1-(2-acetamido-N-[2-(hydroxyamino)-2-oxo-ethyl]anilino)decane-4-sulfinic acid CAS Name: 1-(2-acetamido-N-[2-(hydroxyamino)-2-oxoethyl]anilino)-4-decanesulfinic acid IUPAC Name: 1-(2-acetamido-N-[2-(hydroxyamino)-2-oxoethyl]anilino)decane-4-sulfinic acid Traditional Name: 1-(2-acetamido-N-[2-(hydroxyamino)-2-keto-ethyl]anilino)decane-4-sulfinic acid Formula: C20H33N3O5S MolecularWeight: 427.55812

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CCCN(CC(=O)NO)C1=CC=CC=C1NC(=O)C)S(=O)O

Isomeric SMILES

CCCCCCC(CCCN(CC(=O)NO)C1=CC=CC=C1NC(=O)C)S(=O)O

InChI

InChI=1S/C20H33N3O5S/c1-3-4-5-6-10-17(29(27)28)11-9-14-23(15-20(25)22-26)19-13-8-7-12-18(19)21-16(2)24/h7-8,12-13,17,26H,3-6,9-11,14-15H2,1-2H3,(H,21,24)(H,22,25)(H,27,28)