7-(3-ethenylsulfonylpropylcarbamoylamino)-4-oxidanyl-naphthalene-2-sulfonic acid

Systemtic Name: 7-(3-ethenylsulfonylpropylcarbamoylamino)-4-oxidanyl-naphthalene-2-sulfonic acid Openeye Name: 4-hydroxy-7-(3-vinylsulfonylpropylcarbamoylamino)naphthalene-2-sulfonic acid CAS Name: 7-[[(3-ethenylsulfonylpropylamino)-oxomethyl]amino]-4-hydroxy-2-naphthalenesulfonic acid IUPAC Name: 7-(3-ethenylsulfonylpropylcarbamoylamino)-4-hydroxynaphthalene-2-sulfonic acid Traditional Name: 4-hydroxy-7-(3-vinylsulfonylpropylcarbamoylamino)naphthalene-2-sulfonic acid Formula: C16H18N2O7S2 MolecularWeight: 414.45332

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Descriptors Computed from Structure

Canonical SMILES:

C=CS(=O)(=O)CCCNC(=O)NC1=CC2=CC(=CC(=C2C=C1)O)S(=O)(=O)O

Isomeric SMILES

C=CS(=O)(=O)CCCNC(=O)NC1=CC2=CC(=CC(=C2C=C1)O)S(=O)(=O)O

InChI

InChI=1S/C16H18N2O7S2/c1-2-26(21,22)7-3-6-17-16(20)18-12-4-5-14-11(8-12)9-13(10-15(14)19)27(23,24)25/h2,4-5,8-10,19H,1,3,6-7H2,(H2,17,18,20)(H,23,24,25)