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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CCCN2C3=C(C=C(C=C3)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)C2CCCN2C3=C(C=C(C=C3)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C19H20N2O5/c1-25-15-8-5-13(6-9-15)17-4-3-11-20(17)18-10-7-14(21(23)24)12-16(18)19(22)26-2/h5-10,12,17H,3-4,11H2,1-2H3