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

Systemtic Name: N-cyclopentyl-1-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[(4-benzyloxy-3-methoxy-phenyl)methyl]-N-cyclopentyl-piperidin-1-ium-4-carboxamide CAS Name: N-cyclopentyl-1-[(3-methoxy-4-phenylmethoxyphenyl)methyl]-4-piperidin-1-iumcarboxamide IUPAC Name: N-cyclopentyl-1-[(3-methoxy-4-phenylmethoxyphenyl)methyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-(4-benzoxy-3-methoxy-benzyl)-N-cyclopentyl-piperidin-1-ium-4-carboxamide Formula: C26H35N2O3+ MolecularWeight: 423.5677

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C[NH+]2CCC(CC2)C(=O)NC3CCCC3)OCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=CC(=C1)C[NH+]2CCC(CC2)C(=O)NC3CCCC3)OCC4=CC=CC=C4

InChI

InChI=1S/C26H34N2O3/c1-30-25-17-21(11-12-24(25)31-19-20-7-3-2-4-8-20)18-28-15-13-22(14-16-28)26(29)27-23-9-5-6-10-23/h2-4,7-8,11-12,17,22-23H,5-6,9-10,13-16,18-19H2,1H3,(H,27,29)/p+1