N-cyclopropyl-N-[(1S)-1-[1-[(3-ethoxy-4-oxidanyl-phenyl)methyl]piperidin-1-ium-4-yl]-2-phenyl-ethyl]furan-2-carboxamide

Systemtic Name: N-cyclopropyl-N-[(1S)-1-[1-[(3-ethoxy-4-oxidanyl-phenyl)methyl]piperidin-1-ium-4-yl]-2-phenyl-ethyl]furan-2-carboxamide Openeye Name: N-cyclopropyl-N-[(1S)-1-[1-[(3-ethoxy-4-hydroxy-phenyl)methyl]piperidin-1-ium-4-yl]-2-phenyl-ethyl]furan-2-carboxamide CAS Name: N-cyclopropyl-N-[(1S)-1-[1-[(3-ethoxy-4-hydroxyphenyl)methyl]-4-piperidin-1-iumyl]-2-phenylethyl]-2-furancarboxamide IUPAC Name: N-cyclopropyl-N-[(1S)-1-[1-[(3-ethoxy-4-hydroxyphenyl)methyl]piperidin-1-ium-4-yl]-2-phenylethyl]furan-2-carboxamide Traditional Name: N-cyclopropyl-N-[(1S)-1-[1-(3-ethoxy-4-hydroxy-benzyl)piperidin-1-ium-4-yl]-2-phenyl-ethyl]-2-furamide Formula: C30H37N2O4+ MolecularWeight: 489.62578

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C[NH+]2CCC(CC2)C(CC3=CC=CC=C3)N(C4CC4)C(=O)C5=CC=CO5)O

Isomeric SMILES

CCOC1=C(C=CC(=C1)C[NH+]2CCC(CC2)[C@H](CC3=CC=CC=C3)N(C4CC4)C(=O)C5=CC=CO5)O

InChI

InChI=1S/C30H36N2O4/c1-2-35-29-20-23(10-13-27(29)33)21-31-16-14-24(15-17-31)26(19-22-7-4-3-5-8-22)32(25-11-12-25)30(34)28-9-6-18-36-28/h3-10,13,18,20,24-26,33H,2,11-12,14-17,19,21H2,1H3/p+1/t26-/m0/s1