1-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]-N-(3-morpholin-4-ylpropyl)piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]-N-(3-morpholin-4-ylpropyl)piperidin-1-ium-4-carboxamide Openeye Name: 1-[(4-benzyloxy-3-methoxy-phenyl)methyl]-N-(3-morpholinopropyl)piperidin-1-ium-4-carboxamide CAS Name: 1-[(3-methoxy-4-phenylmethoxyphenyl)methyl]-N-[3-(4-morpholinyl)propyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(3-methoxy-4-phenylmethoxyphenyl)methyl]-N-(3-morpholin-4-ylpropyl)piperidin-1-ium-4-carboxamide Traditional Name: 1-(4-benzoxy-3-methoxy-benzyl)-N-(3-morpholinopropyl)piperidin-1-ium-4-carboxamide Formula: C28H40N3O4+ MolecularWeight: 482.6349

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C[NH+]2CCC(CC2)C(=O)NCCCN3CCOCC3)OCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=CC(=C1)C[NH+]2CCC(CC2)C(=O)NCCCN3CCOCC3)OCC4=CC=CC=C4

InChI

InChI=1S/C28H39N3O4/c1-33-27-20-24(8-9-26(27)35-22-23-6-3-2-4-7-23)21-31-14-10-25(11-15-31)28(32)29-12-5-13-30-16-18-34-19-17-30/h2-4,6-9,20,25H,5,10-19,21-22H2,1H3,(H,29,32)/p+1