2-[2-(naphthalen-2-ylamino)-2-oxidanylidene-ethyl]sulfonyloctanoic acid

Systemtic Name: 2-[2-(naphthalen-2-ylamino)-2-oxidanylidene-ethyl]sulfonyloctanoic acid Openeye Name: 2-[2-(2-naphthylamino)-2-oxo-ethyl]sulfonyloctanoic acid CAS Name: 2-[2-(2-naphthalenylamino)-2-oxoethyl]sulfonyloctanoic acid IUPAC Name: 2-[2-(naphthalen-2-ylamino)-2-oxoethyl]sulfonyloctanoic acid Traditional Name: 2-[2-keto-2-(2-naphthylamino)ethyl]sulfonylcaprylic acid Formula: C20H25NO5S MolecularWeight: 391.4812

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C(=O)O)S(=O)(=O)CC(=O)NC1=CC2=CC=CC=C2C=C1

Isomeric SMILES

CCCCCCC(C(=O)O)S(=O)(=O)CC(=O)NC1=CC2=CC=CC=C2C=C1

InChI

InChI=1S/C20H25NO5S/c1-2-3-4-5-10-18(20(23)24)27(25,26)14-19(22)21-17-12-11-15-8-6-7-9-16(15)13-17/h6-9,11-13,18H,2-5,10,14H2,1H3,(H,21,22)(H,23,24)