N-[(2R)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-morpholin-4-yl-pyridin-1-ium-2-carboxamide

Systemtic Name: N-[(2R)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-morpholin-4-yl-pyridin-1-ium-2-carboxamide Openeye Name: N-[(2R)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-morpholino-pyridin-1-ium-2-carboxamide CAS Name: N-[(2R)-2-(4-methoxyphenyl)-2-(1-pyrrolidin-1-iumyl)ethyl]-4-(4-morpholinyl)-2-pyridin-1-iumcarboxamide IUPAC Name: N-[(2R)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-ylethyl]-4-morpholin-4-ylpyridin-1-ium-2-carboxamide Traditional Name: N-[(2R)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-morpholino-pyridin-1-ium-2-carboxamide Formula: C23H32N4O3+2 MolecularWeight: 412.52518

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CNC(=O)C2=[NH+]C=CC(=C2)N3CCOCC3)[NH+]4CCCC4

Isomeric SMILES

COC1=CC=C(C=C1)[C@H](CNC(=O)C2=[NH+]C=CC(=C2)N3CCOCC3)[NH+]4CCCC4

InChI

InChI=1S/C23H30N4O3/c1-29-20-6-4-18(5-7-20)22(27-10-2-3-11-27)17-25-23(28)21-16-19(8-9-24-21)26-12-14-30-15-13-26/h4-9,16,22H,2-3,10-15,17H2,1H3,(H,25,28)/p+2/t22-/m0/s1