(5-chloranyl-1-methyl-imidazol-2-yl)methyl 5-nitro-2-pyrrolidin-1-yl-benzoate

Systemtic Name: (5-chloranyl-1-methyl-imidazol-2-yl)methyl 5-nitro-2-pyrrolidin-1-yl-benzoate Openeye Name: (5-chloro-1-methyl-imidazol-2-yl)methyl 5-nitro-2-pyrrolidin-1-yl-benzoate CAS Name: 5-nitro-2-(1-pyrrolidinyl)benzoic acid (5-chloro-1-methyl-2-imidazolyl)methyl ester IUPAC Name: (5-chloro-1-methylimidazol-2-yl)methyl 5-nitro-2-pyrrolidin-1-ylbenzoate Traditional Name: 5-nitro-2-pyrrolidino-benzoic acid (5-chloro-1-methyl-imidazol-2-yl)methyl ester Formula: C16H17ClN4O4 MolecularWeight: 364.78358

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CN=C1COC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCCC3)Cl

Isomeric SMILES

CN1C(=CN=C1COC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCCC3)Cl

InChI

InChI=1S/C16H17ClN4O4/c1-19-14(17)9-18-15(19)10-25-16(22)12-8-11(21(23)24)4-5-13(12)20-6-2-3-7-20/h4-5,8-9H,2-3,6-7,10H2,1H3