6-[2-chloroethylsulfonyl(ethyl)amino]-4-oxidanyl-naphthalene-2-sulfonic acid

Systemtic Name: 6-[2-chloroethylsulfonyl(ethyl)amino]-4-oxidanyl-naphthalene-2-sulfonic acid Openeye Name: 6-[2-chloroethylsulfonyl(ethyl)amino]-4-hydroxy-naphthalene-2-sulfonic acid CAS Name: 6-[2-chloroethylsulfonyl(ethyl)amino]-4-hydroxy-2-naphthalenesulfonic acid IUPAC Name: 6-[2-chloroethylsulfonyl(ethyl)amino]-4-hydroxynaphthalene-2-sulfonic acid Traditional Name: 6-[2-chloroethylsulfonyl(ethyl)amino]-4-hydroxy-naphthalene-2-sulfonic acid Formula: C14H16ClNO6S2 MolecularWeight: 393.86294

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC2=C(C=C(C=C2C=C1)S(=O)(=O)O)O)S(=O)(=O)CCCl

Isomeric SMILES

CCN(C1=CC2=C(C=C(C=C2C=C1)S(=O)(=O)O)O)S(=O)(=O)CCCl

InChI

InChI=1S/C14H16ClNO6S2/c1-2-16(23(18,19)6-5-15)11-4-3-10-7-12(24(20,21)22)9-14(17)13(10)8-11/h3-4,7-9,17H,2,5-6H2,1H3,(H,20,21,22)