sodium 3-[6-[2-(2,3-dihydro-1,4-benzothiazin-4-yl)ethoxy]naphthalen-2-yl]-2-methyl-propanoate

Systemtic Name: sodium 3-[6-[2-(2,3-dihydro-1,4-benzothiazin-4-yl)ethoxy]naphthalen-2-yl]-2-methyl-propanoate Openeye Name: sodium 3-[6-[2-(2,3-dihydro-1,4-benzothiazin-4-yl)ethoxy]-2-naphthyl]-2-methyl-propanoate CAS Name: sodium 3-[6-[2-(2,3-dihydro-1,4-benzothiazin-4-yl)ethoxy]-2-naphthalenyl]-2-methylpropanoate IUPAC Name: sodium 3-[6-[2-(2,3-dihydro-1,4-benzothiazin-4-yl)ethoxy]naphthalen-2-yl]-2-methylpropanoate Traditional Name: sodium 3-[6-[2-(2,3-dihydro-1,4-benzothiazin-4-yl)ethoxy]-2-naphthyl]-2-methyl-propionate Formula: C24H24NNaO3S MolecularWeight: 429.50703

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC2=C(C=C1)C=C(C=C2)OCCN3CCSC4=CC=CC=C43)C(=O)[O-].[Na+]

Isomeric SMILES

CC(CC1=CC2=C(C=C1)C=C(C=C2)OCCN3CCSC4=CC=CC=C43)C(=O)[O-].[Na+]

InChI

InChI=1S/C24H25NO3S.Na/c1-17(24(26)27)14-18-6-7-20-16-21(9-8-19(20)15-18)28-12-10-25-11-13-29-23-5-3-2-4-22(23)25;/h2-9,15-17H,10-14H2,1H3,(H,26,27);/q;+1/p-1