tert-butyl 1-(3-phenylpropylcarbamoyl)pyrrolidin-1-ium-1-carboxylate

Systemtic Name: tert-butyl 1-(3-phenylpropylcarbamoyl)pyrrolidin-1-ium-1-carboxylate Openeye Name: tert-butyl 1-(3-phenylpropylcarbamoyl)pyrrolidin-1-ium-1-carboxylate CAS Name: 1-[oxo-(3-phenylpropylamino)methyl]-1-pyrrolidin-1-iumcarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 1-(3-phenylpropylcarbamoyl)pyrrolidin-1-ium-1-carboxylate Traditional Name: 1-(3-phenylpropylcarbamoyl)pyrrolidin-1-ium-1-carboxylic acid tert-butyl ester Formula: C19H29N2O3+ MolecularWeight: 333.44516

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)[N+]1(CCCC1)C(=O)NCCCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)[N+]1(CCCC1)C(=O)NCCCC2=CC=CC=C2

InChI

InChI=1S/C19H28N2O3/c1-19(2,3)24-18(23)21(14-7-8-15-21)17(22)20-13-9-12-16-10-5-4-6-11-16/h4-6,10-11H,7-9,12-15H2,1-3H3/p+1