(2-methoxyphenyl)methyl 3-nitro-4-pyrrolidin-1-yl-benzoate

Systemtic Name: (2-methoxyphenyl)methyl 3-nitro-4-pyrrolidin-1-yl-benzoate Openeye Name: (2-methoxyphenyl)methyl 3-nitro-4-pyrrolidin-1-yl-benzoate CAS Name: 3-nitro-4-(1-pyrrolidinyl)benzoic acid (2-methoxyphenyl)methyl ester IUPAC Name: (2-methoxyphenyl)methyl 3-nitro-4-pyrrolidin-1-ylbenzoate Traditional Name: 3-nitro-4-pyrrolidino-benzoic acid o-anisyl ester Formula: C19H20N2O5 MolecularWeight: 356.3725

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1COC(=O)C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC=C1COC(=O)C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C19H20N2O5/c1-25-18-7-3-2-6-15(18)13-26-19(22)14-8-9-16(17(12-14)21(23)24)20-10-4-5-11-20/h2-3,6-9,12H,4-5,10-11,13H2,1H3