(4-methoxyphenyl)methyl 5-nitro-2-pyrrolidin-1-yl-benzoate

Systemtic Name: (4-methoxyphenyl)methyl 5-nitro-2-pyrrolidin-1-yl-benzoate Openeye Name: (4-methoxyphenyl)methyl 5-nitro-2-pyrrolidin-1-yl-benzoate CAS Name: 5-nitro-2-(1-pyrrolidinyl)benzoic acid (4-methoxyphenyl)methyl ester IUPAC Name: (4-methoxyphenyl)methyl 5-nitro-2-pyrrolidin-1-ylbenzoate Traditional Name: 5-nitro-2-pyrrolidino-benzoic acid p-anisyl ester Formula: C19H20N2O5 MolecularWeight: 356.3725

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)COC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCCC3

Isomeric SMILES

COC1=CC=C(C=C1)COC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCCC3

InChI

InChI=1S/C19H20N2O5/c1-25-16-7-4-14(5-8-16)13-26-19(22)17-12-15(21(23)24)6-9-18(17)20-10-2-3-11-20/h4-9,12H,2-3,10-11,13H2,1H3