N-[(2R)-2-(4-ethoxy-3-methoxy-phenyl)-2-morpholin-4-ium-4-yl-ethyl]-1,2-dihydroacenaphthylene-5-carboxamide

Systemtic Name: N-[(2R)-2-(4-ethoxy-3-methoxy-phenyl)-2-morpholin-4-ium-4-yl-ethyl]-1,2-dihydroacenaphthylene-5-carboxamide Openeye Name: N-[(2R)-2-(4-ethoxy-3-methoxy-phenyl)-2-morpholin-4-ium-4-yl-ethyl]-1,2-dihydroacenaphthylene-5-carboxamide CAS Name: N-[(2R)-2-(4-ethoxy-3-methoxyphenyl)-2-(4-morpholin-4-iumyl)ethyl]-1,2-dihydroacenaphthylene-5-carboxamide IUPAC Name: N-[(2R)-2-(4-ethoxy-3-methoxyphenyl)-2-morpholin-4-ium-4-ylethyl]-1,2-dihydroacenaphthylene-5-carboxamide Traditional Name: N-[(2R)-2-(4-ethoxy-3-methoxy-phenyl)-2-morpholin-4-ium-4-yl-ethyl]acenaphthene-5-carboxamide Formula: C28H33N2O4+ MolecularWeight: 461.57262

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(CNC(=O)C2=C3C=CC=C4C3=C(CC4)C=C2)[NH+]5CCOCC5)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)[C@H](CNC(=O)C2=C3C=CC=C4C3=C(CC4)C=C2)[NH+]5CCOCC5)OC

InChI

InChI=1S/C28H32N2O4/c1-3-34-25-12-10-21(17-26(25)32-2)24(30-13-15-33-16-14-30)18-29-28(31)23-11-9-20-8-7-19-5-4-6-22(23)27(19)20/h4-6,9-12,17,24H,3,7-8,13-16,18H2,1-2H3,(H,29,31)/p+1/t24-/m0/s1