6-azanyl-1-cyclopropyl-4-oxidanylidene-7-piperazin-1-yl-quinoline-2-carboxylic acid

Systemtic Name: 6-azanyl-1-cyclopropyl-4-oxidanylidene-7-piperazin-1-yl-quinoline-2-carboxylic acid Openeye Name: 6-amino-1-cyclopropyl-4-oxo-7-piperazin-1-yl-quinoline-2-carboxylic acid CAS Name: 6-amino-1-cyclopropyl-4-oxo-7-(1-piperazinyl)-2-quinolinecarboxylic acid IUPAC Name: 6-amino-1-cyclopropyl-4-oxo-7-piperazin-1-ylquinoline-2-carboxylic acid Traditional Name: 6-amino-1-cyclopropyl-4-keto-7-piperazino-quinaldic acid Formula: C17H20N4O3 MolecularWeight: 328.3657

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C3=CC(=C(C=C3C(=O)C=C2C(=O)O)N)N4CCNCC4

Isomeric SMILES

C1CC1N2C3=CC(=C(C=C3C(=O)C=C2C(=O)O)N)N4CCNCC4

InChI

InChI=1S/C17H20N4O3/c18-12-7-11-13(8-14(12)20-5-3-19-4-6-20)21(10-1-2-10)15(17(23)24)9-16(11)22/h7-10,19H,1-6,18H2,(H,23,24)