4-(2-oxidanylidene-1,3-benzoxazol-3-yl)-N-(1-propan-2-ylpiperidin-1-ium-4-yl)butanamide

Systemtic Name: 4-(2-oxidanylidene-1,3-benzoxazol-3-yl)-N-(1-propan-2-ylpiperidin-1-ium-4-yl)butanamide Openeye Name: N-(1-isopropylpiperidin-1-ium-4-yl)-4-(2-oxo-1,3-benzoxazol-3-yl)butanamide CAS Name: 4-(2-oxo-1,3-benzoxazol-3-yl)-N-(1-propan-2-yl-4-piperidin-1-iumyl)butanamide IUPAC Name: 4-(2-oxo-1,3-benzoxazol-3-yl)-N-(1-propan-2-ylpiperidin-1-ium-4-yl)butanamide Traditional Name: N-(1-isopropylpiperidin-1-ium-4-yl)-4-(2-keto-1,3-benzoxazol-3-yl)butyramide Formula: C19H28N3O3+ MolecularWeight: 346.44392

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CCC(CC1)NC(=O)CCCN2C3=CC=CC=C3OC2=O

Isomeric SMILES

CC(C)[NH+]1CCC(CC1)NC(=O)CCCN2C3=CC=CC=C3OC2=O

InChI

InChI=1S/C19H27N3O3/c1-14(2)21-12-9-15(10-13-21)20-18(23)8-5-11-22-16-6-3-4-7-17(16)25-19(22)24/h3-4,6-7,14-15H,5,8-13H2,1-2H3,(H,20,23)/p+1