O4-(5-chloranyl-7-iodanyl-quinolin-8-yl) O1-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl] butanedioate

Systemtic Name: O4-(5-chloranyl-7-iodanyl-quinolin-8-yl) O1-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl] butanedioate Openeye Name: O4-(5-chloro-7-iodo-8-quinolyl) O1-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl] butanedioate CAS Name: butanedioic acid O4-(5-chloro-7-iodo-8-quinolinyl) ester O1-[2-(2-methyl-5-nitro-1-imidazolyl)ethyl] ester IUPAC Name: 4-O-(5-chloro-7-iodoquinolin-8-yl) 1-O-[2-(2-methyl-5-nitroimidazol-1-yl)ethyl] butanedioate Traditional Name: succinic acid O4-(5-chloro-7-iodo-8-quinolyl) ester O1-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl] ester Formula: C19H16ClIN4O6 MolecularWeight: 558.71101

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N1CCOC(=O)CCC(=O)OC2=C(C=C(C3=C2N=CC=C3)Cl)I)[N+](=O)[O-]

Isomeric SMILES

CC1=NC=C(N1CCOC(=O)CCC(=O)OC2=C(C=C(C3=C2N=CC=C3)Cl)I)[N+](=O)[O-]

InChI

InChI=1S/C19H16ClIN4O6/c1-11-23-10-15(25(28)29)24(11)7-8-30-16(26)4-5-17(27)31-19-14(21)9-13(20)12-3-2-6-22-18(12)19/h2-3,6,9-10H,4-5,7-8H2,1H3