1-[(3-methoxy-4-oxidanyl-phenyl)methyl]-N-propan-2-yl-piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(3-methoxy-4-oxidanyl-phenyl)methyl]-N-propan-2-yl-piperidin-1-ium-4-carboxamide Openeye Name: 1-[(4-hydroxy-3-methoxy-phenyl)methyl]-N-isopropyl-piperidin-1-ium-4-carboxamide CAS Name: 1-[(4-hydroxy-3-methoxyphenyl)methyl]-N-propan-2-yl-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(4-hydroxy-3-methoxyphenyl)methyl]-N-propan-2-ylpiperidin-1-ium-4-carboxamide Traditional Name: N-isopropyl-1-vanillyl-piperidin-1-ium-4-carboxamide Formula: C17H27N2O3+ MolecularWeight: 307.40788

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1CC[NH+](CC1)CC2=CC(=C(C=C2)O)OC

Isomeric SMILES

CC(C)NC(=O)C1CC[NH+](CC1)CC2=CC(=C(C=C2)O)OC

InChI

InChI=1S/C17H26N2O3/c1-12(2)18-17(21)14-6-8-19(9-7-14)11-13-4-5-15(20)16(10-13)22-3/h4-5,10,12,14,20H,6-9,11H2,1-3H3,(H,18,21)/p+1