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

Systemtic Name: 3-[4-[[(2S)-2-methyl-3,4-dihydro-2H-quinolin-1-yl]sulfonyl]phenyl]propanoate Openeye Name: 3-[4-[[(2S)-2-methyl-3,4-dihydro-2H-quinolin-1-yl]sulfonyl]phenyl]propanoate CAS Name: 3-[4-[[(2S)-2-methyl-3,4-dihydro-2H-quinolin-1-yl]sulfonyl]phenyl]propanoate IUPAC Name: 3-[4-[[(2S)-2-methyl-3,4-dihydro-2H-quinolin-1-yl]sulfonyl]phenyl]propanoate Traditional Name: 3-[4-[[(2S)-2-methyl-3,4-dihydro-2H-quinolin-1-yl]sulfonyl]phenyl]propionate Formula: C19H20NO4S- MolecularWeight: 358.4314

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21NO4S/c1-14-6-10-16-4-2-3-5-18(16)20(14)25(23,24)17-11-7-15(8-12-17)9-13-19(21)22/h2-5,7-8,11-12,14H,6,9-10,13H2,1H3,(H,21,22)/p-1/t14-/m0/s1