ethyl 2-[2-[2-hydroxyethyl-[3-(2-nitroimidazol-1-yl)-2-oxidanyl-propyl]amino]ethylcarbamoyl]indolizine-1-carboxylate

Systemtic Name: ethyl 2-[2-[2-hydroxyethyl-[3-(2-nitroimidazol-1-yl)-2-oxidanyl-propyl]amino]ethylcarbamoyl]indolizine-1-carboxylate Openeye Name: ethyl 2-[2-[2-hydroxyethyl-[2-hydroxy-3-(2-nitroimidazol-1-yl)propyl]amino]ethylcarbamoyl]indolizine-1-carboxylate CAS Name: 2-[[2-[2-hydroxyethyl-[2-hydroxy-3-(2-nitro-1-imidazolyl)propyl]amino]ethylamino]-oxomethyl]-1-indolizinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[2-[2-hydroxyethyl-[2-hydroxy-3-(2-nitroimidazol-1-yl)propyl]amino]ethylcarbamoyl]indolizine-1-carboxylate Traditional Name: 2-[2-[2-hydroxyethyl-[2-hydroxy-3-(2-nitroimidazol-1-yl)propyl]amino]ethylcarbamoyl]indolizine-1-carboxylic acid ethyl ester Formula: C22H28N6O7 MolecularWeight: 488.49372

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2C=CC=CN2C=C1C(=O)NCCN(CCO)CC(CN3C=CN=C3[N+](=O)[O-])O

Isomeric SMILES

CCOC(=O)C1=C2C=CC=CN2C=C1C(=O)NCCN(CCO)CC(CN3C=CN=C3[N+](=O)[O-])O

InChI

InChI=1S/C22H28N6O7/c1-2-35-21(32)19-17(15-26-8-4-3-5-18(19)26)20(31)23-6-9-25(11-12-29)13-16(30)14-27-10-7-24-22(27)28(33)34/h3-5,7-8,10,15-16,29-30H,2,6,9,11-14H2,1H3,(H,23,31)