[1-(1,3-benzoxazol-2-ylmethyl)piperidin-1-ium-4-yl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone

Systemtic Name: [1-(1,3-benzoxazol-2-ylmethyl)piperidin-1-ium-4-yl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone Openeye Name: [1-(1,3-benzoxazol-2-ylmethyl)piperidin-1-ium-4-yl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone CAS Name: [1-(1,3-benzoxazol-2-ylmethyl)-4-piperidin-1-iumyl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone IUPAC Name: [1-(1,3-benzoxazol-2-ylmethyl)piperidin-1-ium-4-yl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone Traditional Name: [1-(1,3-benzoxazol-2-ylmethyl)piperidin-1-ium-4-yl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone Formula: C23H26N3O2+ MolecularWeight: 376.47144

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)N2CCC3=CC=CC=C3C2)CC4=NC5=CC=CC=C5O4

Isomeric SMILES

C1C[NH+](CCC1C(=O)N2CCC3=CC=CC=C3C2)CC4=NC5=CC=CC=C5O4

InChI

InChI=1S/C23H25N3O2/c27-23(26-14-11-17-5-1-2-6-19(17)15-26)18-9-12-25(13-10-18)16-22-24-20-7-3-4-8-21(20)28-22/h1-8,18H,9-16H2/p+1