sodium 5-[4-(prop-2-enoylamino)butoxy]naphthalene-1-sulfonate

Systemtic Name: sodium 5-[4-(prop-2-enoylamino)butoxy]naphthalene-1-sulfonate Openeye Name: sodium 5-[4-(prop-2-enoylamino)butoxy]naphthalene-1-sulfonate CAS Name: sodium 5-[4-(1-oxoprop-2-enylamino)butoxy]-1-naphthalenesulfonate IUPAC Name: sodium 5-[4-(prop-2-enoylamino)butoxy]naphthalene-1-sulfonate Traditional Name: sodium 5-(4-acrylamidobutoxy)naphthalene-1-sulfonate Formula: C17H18NNaO5S MolecularWeight: 371.38329

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Descriptors Computed from Structure

Canonical SMILES:

C=CC(=O)NCCCCOC1=CC=CC2=C1C=CC=C2S(=O)(=O)[O-].[Na+]

Isomeric SMILES

C=CC(=O)NCCCCOC1=CC=CC2=C1C=CC=C2S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C17H19NO5S.Na/c1-2-17(19)18-11-3-4-12-23-15-9-5-8-14-13(15)7-6-10-16(14)24(20,21)22;/h2,5-10H,1,3-4,11-12H2,(H,18,19)(H,20,21,22);/q;+1/p-1