[2-ethoxy-4-[(4-morpholin-4-ylphenyl)iminomethyl]phenyl] 3-methyl-4-nitro-benzoate

Systemtic Name: [2-ethoxy-4-[(4-morpholin-4-ylphenyl)iminomethyl]phenyl] 3-methyl-4-nitro-benzoate Openeye Name: [2-ethoxy-4-[(4-morpholinophenyl)iminomethyl]phenyl] 3-methyl-4-nitro-benzoate CAS Name: 3-methyl-4-nitrobenzoic acid [2-ethoxy-4-[[4-(4-morpholinyl)phenyl]iminomethyl]phenyl] ester IUPAC Name: [2-ethoxy-4-[(4-morpholin-4-ylphenyl)iminomethyl]phenyl] 3-methyl-4-nitrobenzoate Traditional Name: 3-methyl-4-nitro-benzoic acid [2-ethoxy-4-[(4-morpholinophenyl)iminomethyl]phenyl] ester Formula: C27H27N3O6 MolecularWeight: 489.51978

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=NC2=CC=C(C=C2)N3CCOCC3)OC(=O)C4=CC(=C(C=C4)[N+](=O)[O-])C

Isomeric SMILES

CCOC1=C(C=CC(=C1)C=NC2=CC=C(C=C2)N3CCOCC3)OC(=O)C4=CC(=C(C=C4)[N+](=O)[O-])C

InChI

InChI=1S/C27H27N3O6/c1-3-35-26-17-20(18-28-22-6-8-23(9-7-22)29-12-14-34-15-13-29)4-11-25(26)36-27(31)21-5-10-24(30(32)33)19(2)16-21/h4-11,16-18H,3,12-15H2,1-2H3