N-[(2R)-2-(furan-2-yl)-2-morpholin-4-ium-4-yl-ethyl]-3,5-dimethyl-1-benzofuran-2-carboxamide

Systemtic Name: N-[(2R)-2-(furan-2-yl)-2-morpholin-4-ium-4-yl-ethyl]-3,5-dimethyl-1-benzofuran-2-carboxamide Openeye Name: N-[(2R)-2-(2-furyl)-2-morpholin-4-ium-4-yl-ethyl]-3,5-dimethyl-benzofuran-2-carboxamide CAS Name: N-[(2R)-2-(2-furanyl)-2-(4-morpholin-4-iumyl)ethyl]-3,5-dimethyl-2-benzofurancarboxamide IUPAC Name: N-[(2R)-2-(furan-2-yl)-2-morpholin-4-ium-4-ylethyl]-3,5-dimethyl-1-benzofuran-2-carboxamide Traditional Name: N-[(2R)-2-(2-furyl)-2-morpholin-4-ium-4-yl-ethyl]-3,5-dimethyl-coumarilamide Formula: C21H25N2O4+ MolecularWeight: 369.4342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC(=C2C)C(=O)NCC(C3=CC=CO3)[NH+]4CCOCC4

Isomeric SMILES

CC1=CC2=C(C=C1)OC(=C2C)C(=O)NC[C@H](C3=CC=CO3)[NH+]4CCOCC4

InChI

InChI=1S/C21H24N2O4/c1-14-5-6-18-16(12-14)15(2)20(27-18)21(24)22-13-17(19-4-3-9-26-19)23-7-10-25-11-8-23/h3-6,9,12,17H,7-8,10-11,13H2,1-2H3,(H,22,24)/p+1/t17-/m1/s1