(2S)-2-[6-chloranyl-4-(4-methoxyphenyl)-2-methyl-quinolin-3-yl]-2-ethoxy-ethanoic acid

Systemtic Name: (2S)-2-[6-chloranyl-4-(4-methoxyphenyl)-2-methyl-quinolin-3-yl]-2-ethoxy-ethanoic acid Openeye Name: (2S)-2-[6-chloro-4-(4-methoxyphenyl)-2-methyl-3-quinolyl]-2-ethoxy-acetic acid CAS Name: (2S)-2-[6-chloro-4-(4-methoxyphenyl)-2-methyl-3-quinolinyl]-2-ethoxyacetic acid IUPAC Name: (2S)-2-[6-chloro-4-(4-methoxyphenyl)-2-methylquinolin-3-yl]-2-ethoxyacetic acid Traditional Name: (2S)-2-[6-chloro-4-(4-methoxyphenyl)-2-methyl-3-quinolyl]-2-ethoxy-acetic acid Formula: C21H20ClNO4 MolecularWeight: 385.8408

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(C1=C(N=C2C=CC(=CC2=C1C3=CC=C(C=C3)OC)Cl)C)C(=O)O

Isomeric SMILES

CCO[C@@H](C1=C(N=C2C=CC(=CC2=C1C3=CC=C(C=C3)OC)Cl)C)C(=O)O

InChI

InChI=1S/C21H20ClNO4/c1-4-27-20(21(24)25)18-12(2)23-17-10-7-14(22)11-16(17)19(18)13-5-8-15(26-3)9-6-13/h5-11,20H,4H2,1-3H3,(H,24,25)/t20-/m0/s1