2-(2-methyl-5-nitro-imidazol-1-yl)ethyl (E)-octadec-9-enoate

Systemtic Name: 2-(2-methyl-5-nitro-imidazol-1-yl)ethyl (E)-octadec-9-enoate Openeye Name: 2-(2-methyl-5-nitro-imidazol-1-yl)ethyl (E)-octadec-9-enoate CAS Name: (E)-9-octadecenoic acid 2-(2-methyl-5-nitro-1-imidazolyl)ethyl ester IUPAC Name: 2-(2-methyl-5-nitroimidazol-1-yl)ethyl (E)-octadec-9-enoate Traditional Name: (E)-octadec-9-enoic acid 2-(2-methyl-5-nitro-imidazol-1-yl)ethyl ester Formula: C24H41N3O4 MolecularWeight: 435.60004

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)OCCN1C(=NC=C1[N+](=O)[O-])C

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)OCCN1C(=NC=C1[N+](=O)[O-])C

InChI

InChI=1S/C24H41N3O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-24(28)31-20-19-26-22(2)25-21-23(26)27(29)30/h10-11,21H,3-9,12-20H2,1-2H3/b11-10+