7-[3-[azanyl-(5-methyl-1,3-oxazol-2-yl)methyl]pyrrolidin-1-yl]-1-cyclopropyl-8-methyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-[3-[azanyl-(5-methyl-1,3-oxazol-2-yl)methyl]pyrrolidin-1-yl]-1-cyclopropyl-8-methyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-[3-[amino-(5-methyloxazol-2-yl)methyl]pyrrolidin-1-yl]-1-cyclopropyl-8-methyl-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-[3-[amino-(5-methyl-2-oxazolyl)methyl]-1-pyrrolidinyl]-1-cyclopropyl-8-methyl-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-[3-[amino-(5-methyl-1,3-oxazol-2-yl)methyl]pyrrolidin-1-yl]-1-cyclopropyl-8-methyl-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-[3-[amino-(5-methyloxazol-2-yl)methyl]pyrrolidino]-1-cyclopropyl-4-keto-8-methyl-quinoline-3-carboxylic acid Formula: C23H26N4O4 MolecularWeight: 422.47694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(O1)C(C2CCN(C2)C3=C(C4=C(C=C3)C(=O)C(=CN4C5CC5)C(=O)O)C)N

Isomeric SMILES

CC1=CN=C(O1)C(C2CCN(C2)C3=C(C4=C(C=C3)C(=O)C(=CN4C5CC5)C(=O)O)C)N

InChI

InChI=1S/C23H26N4O4/c1-12-9-25-22(31-12)19(24)14-7-8-26(10-14)18-6-5-16-20(13(18)2)27(15-3-4-15)11-17(21(16)28)23(29)30/h5-6,9,11,14-15,19H,3-4,7-8,10,24H2,1-2H3,(H,29,30)