4-(1-butylpiperidin-1-ium-1-yl)-2-propyl-1,3-benzoxazole

Systemtic Name: 4-(1-butylpiperidin-1-ium-1-yl)-2-propyl-1,3-benzoxazole Openeye Name: 4-(1-butylpiperidin-1-ium-1-yl)-2-propyl-1,3-benzoxazole CAS Name: 4-(1-butyl-1-piperidin-1-iumyl)-2-propyl-1,3-benzoxazole IUPAC Name: 4-(1-butylpiperidin-1-ium-1-yl)-2-propyl-1,3-benzoxazole Traditional Name: 4-(1-butylpiperidin-1-ium-1-yl)-2-propyl-1,3-benzoxazole Formula: C19H29N2O+ MolecularWeight: 301.44636

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+]1(CCCCC1)C2=C3C(=CC=C2)OC(=N3)CCC

Isomeric SMILES

CCCC[N+]1(CCCCC1)C2=C3C(=CC=C2)OC(=N3)CCC

InChI

InChI=1S/C19H29N2O/c1-3-5-13-21(14-7-6-8-15-21)16-11-9-12-17-19(16)20-18(22-17)10-4-2/h9,11-12H,3-8,10,13-15H2,1-2H3/q+1