7-(2-methylnaphthalen-1-yl)-2-sulfonyl-heptanoic acid

Systemtic Name: 7-(2-methylnaphthalen-1-yl)-2-sulfonyl-heptanoic acid Openeye Name: 7-(2-methyl-1-naphthyl)-2-sulfonyl-heptanoic acid CAS Name: 7-(2-methyl-1-naphthalenyl)-2-sulfonylheptanoic acid IUPAC Name: 7-(2-methylnaphthalen-1-yl)-2-sulfonylheptanoic acid Traditional Name: 7-(2-methyl-1-naphthyl)-2-sulfonyl-enanthic acid Formula: C18H20O4S MolecularWeight: 332.414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2C=C1)CCCCCC(=S(=O)=O)C(=O)O

Isomeric SMILES

CC1=C(C2=CC=CC=C2C=C1)CCCCCC(=S(=O)=O)C(=O)O

InChI

InChI=1S/C18H20O4S/c1-13-11-12-14-7-5-6-9-16(14)15(13)8-3-2-4-10-17(18(19)20)23(21)22/h5-7,9,11-12H,2-4,8,10H2,1H3,(H,19,20)