4-methylidenepiperidine-1-carboxylic acid; (phenylmethyl) N-(3-oxidanylideneoxiran-2-yl)carbamate

Systemtic Name: 4-methylidenepiperidine-1-carboxylic acid; (phenylmethyl) N-(3-oxidanylideneoxiran-2-yl)carbamate Openeye Name: benzyl N-(3-oxooxiran-2-yl)carbamate; 4-methylenepiperidine-1-carboxylic acid CAS Name: 4-methylene-1-piperidinecarboxylic acid; N-(3-oxo-2-oxiranyl)carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-(3-oxooxiran-2-yl)carbamate; 4-methylidenepiperidine-1-carboxylic acid Traditional Name: N-(3-ketooxiran-2-yl)carbamic acid benzyl ester; 4-methylenepiperidine-1-carboxylic acid Formula: C17H20N2O6 MolecularWeight: 348.3505

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Descriptors Computed from Structure

Canonical SMILES:

C=C1CCN(CC1)C(=O)O.C1=CC=C(C=C1)COC(=O)NC2C(=O)O2

Isomeric SMILES

C=C1CCN(CC1)C(=O)O.C1=CC=C(C=C1)COC(=O)NC2C(=O)O2

InChI

InChI=1S/C10H9NO4.C7H11NO2/c12-9-8(15-9)11-10(13)14-6-7-4-2-1-3-5-7;1-6-2-4-8(5-3-6)7(9)10/h1-5,8H,6H2,(H,11,13);1-5H2,(H,9,10)