(2-cyclopropyl-1,3-benzoxazol-6-yl)-[(3R)-3-(morpholin-4-ium-4-ylmethyl)piperidin-1-yl]methanone

Systemtic Name: (2-cyclopropyl-1,3-benzoxazol-6-yl)-[(3R)-3-(morpholin-4-ium-4-ylmethyl)piperidin-1-yl]methanone Openeye Name: (2-cyclopropyl-1,3-benzoxazol-6-yl)-[(3R)-3-(morpholin-4-ium-4-ylmethyl)-1-piperidyl]methanone CAS Name: (2-cyclopropyl-1,3-benzoxazol-6-yl)-[(3R)-3-(4-morpholin-4-iumylmethyl)-1-piperidinyl]methanone IUPAC Name: (2-cyclopropyl-1,3-benzoxazol-6-yl)-[(3R)-3-(morpholin-4-ium-4-ylmethyl)piperidin-1-yl]methanone Traditional Name: (2-cyclopropyl-1,3-benzoxazol-6-yl)-[(3R)-3-(morpholin-4-ium-4-ylmethyl)piperidino]methanone Formula: C21H28N3O3+ MolecularWeight: 370.46532

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=CC3=C(C=C2)N=C(O3)C4CC4)C[NH+]5CCOCC5

Isomeric SMILES

C1C[C@H](CN(C1)C(=O)C2=CC3=C(C=C2)N=C(O3)C4CC4)C[NH+]5CCOCC5

InChI

InChI=1S/C21H27N3O3/c25-21(17-5-6-18-19(12-17)27-20(22-18)16-3-4-16)24-7-1-2-15(14-24)13-23-8-10-26-11-9-23/h5-6,12,15-16H,1-4,7-11,13-14H2/p+1/t15-/m0/s1