2,2-dimethyl-4-(4-naphthalen-2-ylphenyl)sulfonyl-thiomorpholine-3-carboxylic acid

Systemtic Name: 2,2-dimethyl-4-(4-naphthalen-2-ylphenyl)sulfonyl-thiomorpholine-3-carboxylic acid Openeye Name: 2,2-dimethyl-4-[4-(2-naphthyl)phenyl]sulfonyl-thiomorpholine-3-carboxylic acid CAS Name: 2,2-dimethyl-4-[4-(2-naphthalenyl)phenyl]sulfonyl-3-thiomorpholinecarboxylic acid IUPAC Name: 2,2-dimethyl-4-(4-naphthalen-2-ylphenyl)sulfonylthiomorpholine-3-carboxylic acid Traditional Name: 2,2-dimethyl-4-[4-(2-naphthyl)phenyl]sulfonyl-thiomorpholine-3-carboxylic acid Formula: C23H23NO4S2 MolecularWeight: 441.56302

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N(CCS1)S(=O)(=O)C2=CC=C(C=C2)C3=CC4=CC=CC=C4C=C3)C(=O)O)C

Isomeric SMILES

CC1(C(N(CCS1)S(=O)(=O)C2=CC=C(C=C2)C3=CC4=CC=CC=C4C=C3)C(=O)O)C

InChI

InChI=1S/C23H23NO4S2/c1-23(2)21(22(25)26)24(13-14-29-23)30(27,28)20-11-9-17(10-12-20)19-8-7-16-5-3-4-6-18(16)15-19/h3-12,15,21H,13-14H2,1-2H3,(H,25,26)