N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3,3-dimethyl-N-(2-pyrrolidin-1-ium-1-ylethyl)butanamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3,3-dimethyl-N-(2-pyrrolidin-1-ium-1-ylethyl)butanamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3,3-dimethyl-N-(2-pyrrolidin-1-ium-1-ylethyl)butanamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3,3-dimethyl-N-[2-(1-pyrrolidin-1-iumyl)ethyl]butanamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3,3-dimethyl-N-(2-pyrrolidin-1-ium-1-ylethyl)butanamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3,3-dimethyl-N-(2-pyrrolidin-1-ium-1-ylethyl)butyramide Formula: C21H33N2O3+ MolecularWeight: 361.49832

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)N(CC[NH+]1CCCC1)CC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CC(C)(C)CC(=O)N(CC[NH+]1CCCC1)CC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C21H32N2O3/c1-21(2,3)15-20(24)23(11-10-22-8-4-5-9-22)16-17-6-7-18-19(14-17)26-13-12-25-18/h6-7,14H,4-5,8-13,15-16H2,1-3H3/p+1