[4-[(4-methoxyphenyl)carbamoyl]phenyl]methyl 2-morpholin-4-yl-5-nitro-benzoate

Systemtic Name: [4-[(4-methoxyphenyl)carbamoyl]phenyl]methyl 2-morpholin-4-yl-5-nitro-benzoate Openeye Name: [4-[(4-methoxyphenyl)carbamoyl]phenyl]methyl 2-morpholino-5-nitro-benzoate CAS Name: 2-(4-morpholinyl)-5-nitrobenzoic acid [4-[(4-methoxyanilino)-oxomethyl]phenyl]methyl ester IUPAC Name: [4-[(4-methoxyphenyl)carbamoyl]phenyl]methyl 2-morpholin-4-yl-5-nitrobenzoate Traditional Name: 2-morpholino-5-nitro-benzoic acid [4-[(4-methoxyphenyl)carbamoyl]benzyl] ester Formula: C26H25N3O7 MolecularWeight: 491.4926

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)COC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])N4CCOCC4

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)COC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])N4CCOCC4

InChI

InChI=1S/C26H25N3O7/c1-34-22-9-6-20(7-10-22)27-25(30)19-4-2-18(3-5-19)17-36-26(31)23-16-21(29(32)33)8-11-24(23)28-12-14-35-15-13-28/h2-11,16H,12-15,17H2,1H3,(H,27,30)