4-(1,3-benzodioxol-5-yl)-2-(2,2-dimethylpentyl)pyrrolidine-3-carboxylate

Systemtic Name: 4-(1,3-benzodioxol-5-yl)-2-(2,2-dimethylpentyl)pyrrolidine-3-carboxylate Openeye Name: 4-(1,3-benzodioxol-5-yl)-2-(2,2-dimethylpentyl)pyrrolidine-3-carboxylate CAS Name: 4-(1,3-benzodioxol-5-yl)-2-(2,2-dimethylpentyl)-3-pyrrolidinecarboxylate IUPAC Name: 4-(1,3-benzodioxol-5-yl)-2-(2,2-dimethylpentyl)pyrrolidine-3-carboxylate Traditional Name: 4-(1,3-benzodioxol-5-yl)-2-(2,2-dimethylpentyl)pyrrolidine-3-carboxylate Formula: C19H26NO4- MolecularWeight: 332.41404

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)(C)CC1C(C(CN1)C2=CC3=C(C=C2)OCO3)C(=O)[O-]

Isomeric SMILES

CCCC(C)(C)CC1C(C(CN1)C2=CC3=C(C=C2)OCO3)C(=O)[O-]

InChI

InChI=1S/C19H27NO4/c1-4-7-19(2,3)9-14-17(18(21)22)13(10-20-14)12-5-6-15-16(8-12)24-11-23-15/h5-6,8,13-14,17,20H,4,7,9-11H2,1-3H3,(H,21,22)/p-1