N-[2-(furan-2-yl)-2-morpholin-4-ium-4-yl-ethyl]-3,4,6-trimethyl-1-benzofuran-2-carboxamide chloride

Systemtic Name: N-[2-(furan-2-yl)-2-morpholin-4-ium-4-yl-ethyl]-3,4,6-trimethyl-1-benzofuran-2-carboxamide chloride Openeye Name: N-[2-(2-furyl)-2-morpholin-4-ium-4-yl-ethyl]-3,4,6-trimethyl-benzofuran-2-carboxamide chloride CAS Name: N-[2-(2-furanyl)-2-(4-morpholin-4-iumyl)ethyl]-3,4,6-trimethyl-2-benzofurancarboxamide chloride IUPAC Name: N-[2-(furan-2-yl)-2-morpholin-4-ium-4-ylethyl]-3,4,6-trimethyl-1-benzofuran-2-carboxamide chloride Traditional Name: N-[2-(2-furyl)-2-morpholin-4-ium-4-yl-ethyl]-3,4,6-trimethyl-coumarilamide chloride Formula: C22H27ClN2O4 MolecularWeight: 418.91378

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C(OC2=C1)C(=O)NCC(C3=CC=CO3)[NH+]4CCOCC4)C)C.[Cl-]

Isomeric SMILES

CC1=CC(=C2C(=C(OC2=C1)C(=O)NCC(C3=CC=CO3)[NH+]4CCOCC4)C)C.[Cl-]

InChI

InChI=1S/C22H26N2O4.ClH/c1-14-11-15(2)20-16(3)21(28-19(20)12-14)22(25)23-13-17(18-5-4-8-27-18)24-6-9-26-10-7-24;/h4-5,8,11-12,17H,6-7,9-10,13H2,1-3H3,(H,23,25);1H