[4-(3-morpholin-4-yl-3-oxidanylidene-propyl)-2-(phenylcarbonyloxy)phenyl] benzoate

Systemtic Name: [4-(3-morpholin-4-yl-3-oxidanylidene-propyl)-2-(phenylcarbonyloxy)phenyl] benzoate Openeye Name: [2-benzoyloxy-4-(3-morpholino-3-oxo-propyl)phenyl] benzoate CAS Name: benzoic acid [2-benzoyloxy-4-[3-(4-morpholinyl)-3-oxopropyl]phenyl] ester IUPAC Name: [2-benzoyloxy-4-(3-morpholin-4-yl-3-oxopropyl)phenyl] benzoate Traditional Name: benzoic acid [2-benzoyloxy-4-(3-keto-3-morpholino-propyl)phenyl] ester Formula: C27H25NO6 MolecularWeight: 459.4905

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)CCC2=CC(=C(C=C2)OC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4

Isomeric SMILES

C1COCCN1C(=O)CCC2=CC(=C(C=C2)OC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4

InChI

InChI=1S/C27H25NO6/c29-25(28-15-17-32-18-16-28)14-12-20-11-13-23(33-26(30)21-7-3-1-4-8-21)24(19-20)34-27(31)22-9-5-2-6-10-22/h1-11,13,19H,12,14-18H2