7-[(3R)-3-(2-azanylpropan-2-yl)pyrrolidin-1-yl]-1-cyclopropyl-8-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-[(3R)-3-(2-azanylpropan-2-yl)pyrrolidin-1-yl]-1-cyclopropyl-8-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-[(3R)-3-(1-amino-1-methyl-ethyl)pyrrolidin-1-yl]-1-cyclopropyl-8-methoxy-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-[(3R)-3-(2-aminopropan-2-yl)-1-pyrrolidinyl]-1-cyclopropyl-8-methoxy-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-[(3R)-3-(2-aminopropan-2-yl)pyrrolidin-1-yl]-1-cyclopropyl-8-methoxy-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-[(3R)-3-(1-amino-1-methyl-ethyl)pyrrolidino]-1-cyclopropyl-4-keto-8-methoxy-quinoline-3-carboxylic acid Formula: C21H27N3O4 MolecularWeight: 385.45678

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1CCN(C1)C2=C(C3=C(C=C2)C(=O)C(=CN3C4CC4)C(=O)O)OC)N

Isomeric SMILES

CC(C)([C@@H]1CCN(C1)C2=C(C3=C(C=C2)C(=O)C(=CN3C4CC4)C(=O)O)OC)N

InChI

InChI=1S/C21H27N3O4/c1-21(2,22)12-8-9-23(10-12)16-7-6-14-17(19(16)28-3)24(13-4-5-13)11-15(18(14)25)20(26)27/h6-7,11-13H,4-5,8-10,22H2,1-3H3,(H,26,27)/t12-/m1/s1