4-methyl-3-[[(2S)-2-methyl-3,4-dihydro-2H-quinolin-1-yl]sulfonyl]benzoate

Systemtic Name: 4-methyl-3-[[(2S)-2-methyl-3,4-dihydro-2H-quinolin-1-yl]sulfonyl]benzoate Openeye Name: 4-methyl-3-[[(2S)-2-methyl-3,4-dihydro-2H-quinolin-1-yl]sulfonyl]benzoate CAS Name: 4-methyl-3-[[(2S)-2-methyl-3,4-dihydro-2H-quinolin-1-yl]sulfonyl]benzoate IUPAC Name: 4-methyl-3-[[(2S)-2-methyl-3,4-dihydro-2H-quinolin-1-yl]sulfonyl]benzoate Traditional Name: 4-methyl-3-[[(2S)-2-methyl-3,4-dihydro-2H-quinolin-1-yl]sulfonyl]benzoate Formula: C18H18NO4S- MolecularWeight: 344.40482

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=CC=CC=C2N1S(=O)(=O)C3=C(C=CC(=C3)C(=O)[O-])C

Isomeric SMILES

C[C@H]1CCC2=CC=CC=C2N1S(=O)(=O)C3=C(C=CC(=C3)C(=O)[O-])C

InChI

InChI=1S/C18H19NO4S/c1-12-7-9-15(18(20)21)11-17(12)24(22,23)19-13(2)8-10-14-5-3-4-6-16(14)19/h3-7,9,11,13H,8,10H2,1-2H3,(H,20,21)/p-1/t13-/m0/s1