ethyl 2-methyl-1-[[methyl-[3-(2-nitroimidazol-1-yl)propyl]amino]methyl]indolizine-3-carboxylate

Systemtic Name: ethyl 2-methyl-1-[[methyl-[3-(2-nitroimidazol-1-yl)propyl]amino]methyl]indolizine-3-carboxylate Openeye Name: ethyl 2-methyl-1-[[methyl-[3-(2-nitroimidazol-1-yl)propyl]amino]methyl]indolizine-3-carboxylate CAS Name: 2-methyl-1-[[methyl-[3-(2-nitro-1-imidazolyl)propyl]amino]methyl]-3-indolizinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-methyl-1-[[methyl-[3-(2-nitroimidazol-1-yl)propyl]amino]methyl]indolizine-3-carboxylate Traditional Name: 2-methyl-1-[[methyl-[3-(2-nitroimidazol-1-yl)propyl]amino]methyl]indolizine-3-carboxylic acid ethyl ester Formula: C20H25N5O4 MolecularWeight: 399.4436

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C2N1C=CC=C2)CN(C)CCCN3C=CN=C3[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)C1=C(C(=C2N1C=CC=C2)CN(C)CCCN3C=CN=C3[N+](=O)[O-])C

InChI

InChI=1S/C20H25N5O4/c1-4-29-19(26)18-15(2)16(17-8-5-6-12-24(17)18)14-22(3)10-7-11-23-13-9-21-20(23)25(27)28/h5-6,8-9,12-13H,4,7,10-11,14H2,1-3H3