1-cyclopropyl-7-[4-(2-hydroxyethyl)piperazin-1-yl]-4-oxidanylidene-cinnoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-7-[4-(2-hydroxyethyl)piperazin-1-yl]-4-oxidanylidene-cinnoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-7-[4-(2-hydroxyethyl)piperazin-1-yl]-4-oxo-cinnoline-3-carboxylic acid CAS Name: 1-cyclopropyl-7-[4-(2-hydroxyethyl)-1-piperazinyl]-4-oxo-3-cinnolinecarboxylic acid IUPAC Name: 1-cyclopropyl-7-[4-(2-hydroxyethyl)piperazin-1-yl]-4-oxocinnoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-7-[4-(2-hydroxyethyl)piperazino]-4-keto-cinnoline-3-carboxylic acid Formula: C18H22N4O4 MolecularWeight: 358.39168

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C3=C(C=CC(=C3)N4CCN(CC4)CCO)C(=O)C(=N2)C(=O)O

Isomeric SMILES

C1CC1N2C3=C(C=CC(=C3)N4CCN(CC4)CCO)C(=O)C(=N2)C(=O)O

InChI

InChI=1S/C18H22N4O4/c23-10-9-20-5-7-21(8-6-20)13-3-4-14-15(11-13)22(12-1-2-12)19-16(17(14)24)18(25)26/h3-4,11-12,23H,1-2,5-10H2,(H,25,26)