morpholin-4-yl-[3-[1-(1,2-oxazol-3-ylmethyl)piperidin-1-ium-4-yl]oxyphenyl]methanone

Systemtic Name: morpholin-4-yl-[3-[1-(1,2-oxazol-3-ylmethyl)piperidin-1-ium-4-yl]oxyphenyl]methanone Openeye Name: [3-[1-(isoxazol-3-ylmethyl)piperidin-1-ium-4-yl]oxyphenyl]-morpholino-methanone CAS Name: [3-[[1-(3-isoxazolylmethyl)-4-piperidin-1-iumyl]oxy]phenyl]-(4-morpholinyl)methanone IUPAC Name: morpholin-4-yl-[3-[1-(1,2-oxazol-3-ylmethyl)piperidin-1-ium-4-yl]oxyphenyl]methanone Traditional Name: [3-[1-(isoxazol-3-ylmethyl)piperidin-1-ium-4-yl]oxyphenyl]-morpholino-methanone Formula: C20H26N3O4+ MolecularWeight: 372.43814

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1OC2=CC=CC(=C2)C(=O)N3CCOCC3)CC4=NOC=C4

Isomeric SMILES

C1C[NH+](CCC1OC2=CC=CC(=C2)C(=O)N3CCOCC3)CC4=NOC=C4

InChI

InChI=1S/C20H25N3O4/c24-20(23-9-12-25-13-10-23)16-2-1-3-19(14-16)27-18-4-7-22(8-5-18)15-17-6-11-26-21-17/h1-3,6,11,14,18H,4-5,7-10,12-13,15H2/p+1