6,8-bis(chloranyl)-1-cyclopropyl-1-oxidanidyl-4-piperazin-1-yl-quinolin-1-ium-4-carboxylic acid

Systemtic Name: 6,8-bis(chloranyl)-1-cyclopropyl-1-oxidanidyl-4-piperazin-1-yl-quinolin-1-ium-4-carboxylic acid Openeye Name: 6,8-dichloro-1-cyclopropyl-1-oxido-4-piperazin-1-yl-quinolin-1-ium-4-carboxylic acid CAS Name: 6,8-dichloro-1-cyclopropyl-1-oxido-4-(1-piperazinyl)-4-quinolin-1-iumcarboxylic acid IUPAC Name: 6,8-dichloro-1-cyclopropyl-1-oxido-4-piperazin-1-ylquinolin-1-ium-4-carboxylic acid Traditional Name: 6,8-dichloro-1-cyclopropyl-1-oxido-4-piperazino-quinolin-1-ium-4-carboxylic acid Formula: C17H19Cl2N3O3 MolecularWeight: 384.25706

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1[N+]2(C=CC(C3=CC(=CC(=C32)Cl)Cl)(C(=O)O)N4CCNCC4)[O-]

Isomeric SMILES

C1CC1[N+]2(C=CC(C3=CC(=CC(=C32)Cl)Cl)(C(=O)O)N4CCNCC4)[O-]

InChI

InChI=1S/C17H19Cl2N3O3/c18-11-9-13-15(14(19)10-11)22(25,12-1-2-12)8-3-17(13,16(23)24)21-6-4-20-5-7-21/h3,8-10,12,20H,1-2,4-7H2,(H,23,24)