sodium 3-[2-(1-chloranylnaphthalen-2-yl)oxypropanoyloxy]propane-1-sulfonic acid

Systemtic Name: sodium 3-[2-(1-chloranylnaphthalen-2-yl)oxypropanoyloxy]propane-1-sulfonic acid Openeye Name: sodium 3-[2-[(1-chloro-2-naphthyl)oxy]propanoyloxy]propane-1-sulfonic acid CAS Name: sodium 3-[2-[(1-chloro-2-naphthalenyl)oxy]-1-oxopropoxy]-1-propanesulfonic acid IUPAC Name: sodium 3-[2-(1-chloronaphthalen-2-yl)oxypropanoyloxy]propane-1-sulfonic acid Traditional Name: sodium 3-[2-(1-chloro-2-naphthoxy)propanoyloxy]propane-1-sulfonic acid Formula: C16H17ClNaO6S+ MolecularWeight: 395.81035

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCCCS(=O)(=O)O)OC1=C(C2=CC=CC=C2C=C1)Cl.[Na+]

Isomeric SMILES

CC(C(=O)OCCCS(=O)(=O)O)OC1=C(C2=CC=CC=C2C=C1)Cl.[Na+]

InChI

InChI=1S/C16H17ClO6S.Na/c1-11(16(18)22-9-4-10-24(19,20)21)23-14-8-7-12-5-2-3-6-13(12)15(14)17;/h2-3,5-8,11H,4,9-10H2,1H3,(H,19,20,21);/q;+1