5-(2-morpholin-4-ium-4-ylethylamino)naphthalene-1-sulfonate

Systemtic Name: 5-(2-morpholin-4-ium-4-ylethylamino)naphthalene-1-sulfonate Openeye Name: 5-(2-morpholin-4-ium-4-ylethylamino)naphthalene-1-sulfonate CAS Name: 5-[2-(4-morpholin-4-iumyl)ethylamino]-1-naphthalenesulfonate IUPAC Name: 5-(2-morpholin-4-ium-4-ylethylamino)naphthalene-1-sulfonate Traditional Name: 5-(2-morpholin-4-ium-4-ylethylamino)naphthalene-1-sulfonate Formula: C16H20N2O4S MolecularWeight: 336.406

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCNC2=CC=CC3=C2C=CC=C3S(=O)(=O)[O-]

Isomeric SMILES

C1COCC[NH+]1CCNC2=CC=CC3=C2C=CC=C3S(=O)(=O)[O-]

InChI

InChI=1S/C16H20N2O4S/c19-23(20,21)16-6-2-3-13-14(16)4-1-5-15(13)17-7-8-18-9-11-22-12-10-18/h1-6,17H,7-12H2,(H,19,20,21)