4-[2-methoxy-4-(3-morpholin-4-ylpropyl)phenyl]benzoic acid

Systemtic Name: 4-[2-methoxy-4-(3-morpholin-4-ylpropyl)phenyl]benzoic acid Openeye Name: 4-[2-methoxy-4-(3-morpholinopropyl)phenyl]benzoic acid CAS Name: 4-[2-methoxy-4-[3-(4-morpholinyl)propyl]phenyl]benzoic acid IUPAC Name: 4-[2-methoxy-4-(3-morpholin-4-ylpropyl)phenyl]benzoic acid Traditional Name: 4-[2-methoxy-4-(3-morpholinopropyl)phenyl]benzoic acid Formula: C21H25NO4 MolecularWeight: 355.4275

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CCCN2CCOCC2)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

COC1=C(C=CC(=C1)CCCN2CCOCC2)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C21H25NO4/c1-25-20-15-16(3-2-10-22-11-13-26-14-12-22)4-9-19(20)17-5-7-18(8-6-17)21(23)24/h4-9,15H,2-3,10-14H2,1H3,(H,23,24)