6-(3-azanylpropyl)-1-(2-methoxyethyl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 6-(3-azanylpropyl)-1-(2-methoxyethyl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 6-(3-aminopropyl)-1-(2-methoxyethyl)-4-oxo-quinoline-3-carboxylic acid CAS Name: 6-(3-aminopropyl)-1-(2-methoxyethyl)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 6-(3-aminopropyl)-1-(2-methoxyethyl)-4-oxoquinoline-3-carboxylic acid Traditional Name: 6-(3-aminopropyl)-4-keto-1-(2-methoxyethyl)quinoline-3-carboxylic acid Formula: C16H20N2O4 MolecularWeight: 304.341

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C=C(C(=O)C2=C1C=CC(=C2)CCCN)C(=O)O

Isomeric SMILES

COCCN1C=C(C(=O)C2=C1C=CC(=C2)CCCN)C(=O)O

InChI

InChI=1S/C16H20N2O4/c1-22-8-7-18-10-13(16(20)21)15(19)12-9-11(3-2-6-17)4-5-14(12)18/h4-5,9-10H,2-3,6-8,17H2,1H3,(H,20,21)