7-[3-[azanyl-(5-methyl-1,3-oxazol-2-yl)methyl]pyrrolidin-1-yl]-6-chloranyl-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]-6-chloranyl-1-cyclopropyl-8-methyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-[3-[amino-(5-methyloxazol-2-yl)methyl]pyrrolidin-1-yl]-6-chloro-1-cyclopropyl-8-methyl-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-[3-[amino-(5-methyl-2-oxazolyl)methyl]-1-pyrrolidinyl]-6-chloro-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]-6-chloro-1-cyclopropyl-8-methyl-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-[3-[amino-(5-methyloxazol-2-yl)methyl]pyrrolidino]-6-chloro-1-cyclopropyl-4-keto-8-methyl-quinoline-3-carboxylic acid Formula: C23H25ClN4O4 MolecularWeight: 456.922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(O1)C(C2CCN(C2)C3=C(C=C4C(=C3C)N(C=C(C4=O)C(=O)O)C5CC5)Cl)N

Isomeric SMILES

CC1=CN=C(O1)C(C2CCN(C2)C3=C(C=C4C(=C3C)N(C=C(C4=O)C(=O)O)C5CC5)Cl)N

InChI

InChI=1S/C23H25ClN4O4/c1-11-8-26-22(32-11)18(25)13-5-6-27(9-13)20-12(2)19-15(7-17(20)24)21(29)16(23(30)31)10-28(19)14-3-4-14/h7-8,10,13-14,18H,3-6,9,25H2,1-2H3,(H,30,31)