1-(4-methylphenyl)ethyl 4-morpholin-4-yl-3-nitro-benzoate

Systemtic Name: 1-(4-methylphenyl)ethyl 4-morpholin-4-yl-3-nitro-benzoate Openeye Name: 1-(p-tolyl)ethyl 4-morpholino-3-nitro-benzoate CAS Name: 4-(4-morpholinyl)-3-nitrobenzoic acid 1-(4-methylphenyl)ethyl ester IUPAC Name: 1-(4-methylphenyl)ethyl 4-morpholin-4-yl-3-nitrobenzoate Traditional Name: 4-morpholino-3-nitro-benzoic acid 1-(p-tolyl)ethyl ester Formula: C20H22N2O5 MolecularWeight: 370.39908

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N2O5/c1-14-3-5-16(6-4-14)15(2)27-20(23)17-7-8-18(19(13-17)22(24)25)21-9-11-26-12-10-21/h3-8,13,15H,9-12H2,1-2H3