(4-methylphenyl)methyl 4-morpholin-4-yl-3-nitro-benzoate

Systemtic Name: (4-methylphenyl)methyl 4-morpholin-4-yl-3-nitro-benzoate Openeye Name: p-tolylmethyl 4-morpholino-3-nitro-benzoate CAS Name: 4-(4-morpholinyl)-3-nitrobenzoic acid (4-methylphenyl)methyl ester IUPAC Name: (4-methylphenyl)methyl 4-morpholin-4-yl-3-nitrobenzoate Traditional Name: 4-morpholino-3-nitro-benzoic acid (4-methylbenzyl) ester Formula: C19H20N2O5 MolecularWeight: 356.3725

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)COC(=O)C2=CC(=C(C=C2)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)COC(=O)C2=CC(=C(C=C2)N3CCOCC3)[N+](=O)[O-]

InChI

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