7-[2-(1-azanylethyl)-5-ethyl-pyrrolidin-1-yl]-8-chloranyl-1-cyclopropyl-6-oxidanyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-[2-(1-azanylethyl)-5-ethyl-pyrrolidin-1-yl]-8-chloranyl-1-cyclopropyl-6-oxidanyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-[2-(1-aminoethyl)-5-ethyl-pyrrolidin-1-yl]-8-chloro-1-cyclopropyl-6-hydroxy-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-[2-(1-aminoethyl)-5-ethyl-1-pyrrolidinyl]-8-chloro-1-cyclopropyl-6-hydroxy-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-[2-(1-aminoethyl)-5-ethylpyrrolidin-1-yl]-8-chloro-1-cyclopropyl-6-hydroxy-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-[2-(1-aminoethyl)-5-ethyl-pyrrolidino]-8-chloro-1-cyclopropyl-6-hydroxy-4-keto-quinoline-3-carboxylic acid Formula: C21H26ClN3O4 MolecularWeight: 419.90184

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC(N1C2=C(C=C3C(=C2Cl)N(C=C(C3=O)C(=O)O)C4CC4)O)C(C)N

Isomeric SMILES

CCC1CCC(N1C2=C(C=C3C(=C2Cl)N(C=C(C3=O)C(=O)O)C4CC4)O)C(C)N

InChI

InChI=1S/C21H26ClN3O4/c1-3-11-6-7-15(10(2)23)25(11)19-16(26)8-13-18(17(19)22)24(12-4-5-12)9-14(20(13)27)21(28)29/h8-12,15,26H,3-7,23H2,1-2H3,(H,28,29)