1-ethyl-8-methyl-4-oxidanylidene-7-piperazin-1-yl-quinoline-3-carboxylic acid

Systemtic Name: 1-ethyl-8-methyl-4-oxidanylidene-7-piperazin-1-yl-quinoline-3-carboxylic acid Openeye Name: 1-ethyl-8-methyl-4-oxo-7-piperazin-1-yl-quinoline-3-carboxylic acid CAS Name: 1-ethyl-8-methyl-4-oxo-7-(1-piperazinyl)-3-quinolinecarboxylic acid IUPAC Name: 1-ethyl-8-methyl-4-oxo-7-piperazin-1-ylquinoline-3-carboxylic acid Traditional Name: 1-ethyl-4-keto-8-methyl-7-piperazino-quinoline-3-carboxylic acid Formula: C17H21N3O3 MolecularWeight: 315.36694

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=C1C(=C(C=C2)N3CCNCC3)C)C(=O)O

Isomeric SMILES

CCN1C=C(C(=O)C2=C1C(=C(C=C2)N3CCNCC3)C)C(=O)O

InChI

InChI=1S/C17H21N3O3/c1-3-19-10-13(17(22)23)16(21)12-4-5-14(11(2)15(12)19)20-8-6-18-7-9-20/h4-5,10,18H,3,6-9H2,1-2H3,(H,22,23)