4-(azepan-1-yl)-2-methyl-quinoline-6-carboxylic acid

Systemtic Name: 4-(azepan-1-yl)-2-methyl-quinoline-6-carboxylic acid Openeye Name: 4-(azepan-1-yl)-2-methyl-quinoline-6-carboxylic acid CAS Name: 4-(1-azepanyl)-2-methyl-6-quinolinecarboxylic acid IUPAC Name: 4-(azepan-1-yl)-2-methylquinoline-6-carboxylic acid Traditional Name: 4-(azepan-1-yl)-2-methyl-quinoline-6-carboxylic acid Formula: C17H20N2O2 MolecularWeight: 284.3529

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)C(=O)O)C(=C1)N3CCCCCC3

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)C(=O)O)C(=C1)N3CCCCCC3

InChI

InChI=1S/C17H20N2O2/c1-12-10-16(19-8-4-2-3-5-9-19)14-11-13(17(20)21)6-7-15(14)18-12/h6-7,10-11H,2-5,8-9H2,1H3,(H,20,21)