[4-[methyl(thiophen-2-ylsulfonyl)amino]phenyl] naphthalene-2-sulfonate

Systemtic Name: [4-[methyl(thiophen-2-ylsulfonyl)amino]phenyl] naphthalene-2-sulfonate Openeye Name: [4-[methyl(2-thienylsulfonyl)amino]phenyl] naphthalene-2-sulfonate CAS Name: 2-naphthalenesulfonic acid [4-[methyl(thiophen-2-ylsulfonyl)amino]phenyl] ester IUPAC Name: [4-[methyl(thiophen-2-ylsulfonyl)amino]phenyl] naphthalene-2-sulfonate Traditional Name: naphthalene-2-sulfonic acid [4-[methyl(2-thienylsulfonyl)amino]phenyl] ester Formula: C21H17NO5S3 MolecularWeight: 459.55838

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=C(C=C1)OS(=O)(=O)C2=CC3=CC=CC=C3C=C2)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

CN(C1=CC=C(C=C1)OS(=O)(=O)C2=CC3=CC=CC=C3C=C2)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C21H17NO5S3/c1-22(29(23,24)21-7-4-14-28-21)18-9-11-19(12-10-18)27-30(25,26)20-13-8-16-5-2-3-6-17(16)15-20/h2-15H,1H3