2-methyl-8-(5-oxidanyl-2-oxidanylidene-pentyl)-5,6,7,8-tetrahydroquinoline-3-carboxylic acid

Systemtic Name: 2-methyl-8-(5-oxidanyl-2-oxidanylidene-pentyl)-5,6,7,8-tetrahydroquinoline-3-carboxylic acid Openeye Name: 8-(5-hydroxy-2-oxo-pentyl)-2-methyl-5,6,7,8-tetrahydroquinoline-3-carboxylic acid CAS Name: 8-(5-hydroxy-2-oxopentyl)-2-methyl-5,6,7,8-tetrahydroquinoline-3-carboxylic acid IUPAC Name: 8-(5-hydroxy-2-oxopentyl)-2-methyl-5,6,7,8-tetrahydroquinoline-3-carboxylic acid Traditional Name: 8-(5-hydroxy-2-keto-pentyl)-2-methyl-5,6,7,8-tetrahydroquinoline-3-carboxylic acid Formula: C16H21NO4 MolecularWeight: 291.34224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(CCCC2CC(=O)CCCO)C=C1C(=O)O

Isomeric SMILES

CC1=NC2=C(CCCC2CC(=O)CCCO)C=C1C(=O)O

InChI

InChI=1S/C16H21NO4/c1-10-14(16(20)21)9-12-5-2-4-11(15(12)17-10)8-13(19)6-3-7-18/h9,11,18H,2-8H2,1H3,(H,20,21)