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

Systemtic Name: N-[(2R)-2-(furan-2-yl)-2-morpholin-4-ium-4-yl-ethyl]-3,4,6-trimethyl-1-benzofuran-2-carboxamide Openeye Name: N-[(2R)-2-(2-furyl)-2-morpholin-4-ium-4-yl-ethyl]-3,4,6-trimethyl-benzofuran-2-carboxamide CAS Name: N-[(2R)-2-(2-furanyl)-2-(4-morpholin-4-iumyl)ethyl]-3,4,6-trimethyl-2-benzofurancarboxamide IUPAC Name: N-[(2R)-2-(furan-2-yl)-2-morpholin-4-ium-4-ylethyl]-3,4,6-trimethyl-1-benzofuran-2-carboxamide Traditional Name: N-[(2R)-2-(2-furyl)-2-morpholin-4-ium-4-yl-ethyl]-3,4,6-trimethyl-coumarilamide Formula: C22H27N2O4+ MolecularWeight: 383.46078

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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

Isomeric SMILES

CC1=CC(=C2C(=C(OC2=C1)C(=O)NC[C@H](C3=CC=CO3)[NH+]4CCOCC4)C)C

InChI

InChI=1S/C22H26N2O4/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)/p+1/t17-/m1/s1