5-[(E)-3-(2-chloranyl-7-methyl-quinolin-3-yl)prop-2-enoyl]-2-oxidanyl-benzoic acid

Systemtic Name: 5-[(E)-3-(2-chloranyl-7-methyl-quinolin-3-yl)prop-2-enoyl]-2-oxidanyl-benzoic acid Openeye Name: 5-[(E)-3-(2-chloro-7-methyl-3-quinolyl)prop-2-enoyl]-2-hydroxy-benzoic acid CAS Name: 5-[(E)-3-(2-chloro-7-methyl-3-quinolinyl)-1-oxoprop-2-enyl]-2-hydroxybenzoic acid IUPAC Name: 5-[(E)-3-(2-chloro-7-methylquinolin-3-yl)prop-2-enoyl]-2-hydroxybenzoic acid Traditional Name: 5-[(E)-3-(2-chloro-7-methyl-3-quinolyl)acryloyl]-2-hydroxy-benzoic acid Formula: C20H14ClNO4 MolecularWeight: 367.78246

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NC(=C(C=C2C=C1)C=CC(=O)C3=CC(=C(C=C3)O)C(=O)O)Cl

Isomeric SMILES

CC1=CC2=NC(=C(C=C2C=C1)/C=C/C(=O)C3=CC(=C(C=C3)O)C(=O)O)Cl

InChI

InChI=1S/C20H14ClNO4/c1-11-2-3-12-9-14(19(21)22-16(12)8-11)5-6-17(23)13-4-7-18(24)15(10-13)20(25)26/h2-10,24H,1H3,(H,25,26)/b6-5+