2-[(E)-[[5-(3-ethoxypropylcarbamoyl)pyridin-2-yl]hydrazinylidene]methyl]benzenesulfonic acid

Systemtic Name: 2-[(E)-[[5-(3-ethoxypropylcarbamoyl)pyridin-2-yl]hydrazinylidene]methyl]benzenesulfonic acid Openeye Name: 2-[(E)-[[5-(3-ethoxypropylcarbamoyl)-2-pyridyl]hydrazono]methyl]benzenesulfonic acid CAS Name: 2-[(E)-[[5-[(3-ethoxypropylamino)-oxomethyl]-2-pyridinyl]hydrazinylidene]methyl]benzenesulfonic acid IUPAC Name: 2-[(E)-[[5-(3-ethoxypropylcarbamoyl)pyridin-2-yl]hydrazinylidene]methyl]benzenesulfonic acid Traditional Name: 2-[(E)-[[5-(3-ethoxypropylcarbamoyl)-2-pyridyl]hydrazono]methyl]besylic acid Formula: C18H22N4O5S MolecularWeight: 406.45608

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNC(=O)C1=CN=C(C=C1)NN=CC2=CC=CC=C2S(=O)(=O)O

Isomeric SMILES

CCOCCCNC(=O)C1=CN=C(C=C1)N/N=C/C2=CC=CC=C2S(=O)(=O)O

InChI

InChI=1S/C18H22N4O5S/c1-2-27-11-5-10-19-18(23)15-8-9-17(20-12-15)22-21-13-14-6-3-4-7-16(14)28(24,25)26/h3-4,6-9,12-13H,2,5,10-11H2,1H3,(H,19,23)(H,20,22)(H,24,25,26)/b21-13+