ethyl N-ethoxycarbonyl-N-methanoyl-carbamate; 1-phenylmethoxycarbonylaziridine-2-carboxylic acid

Systemtic Name: ethyl N-ethoxycarbonyl-N-methanoyl-carbamate; 1-phenylmethoxycarbonylaziridine-2-carboxylic acid Openeye Name: 1-benzyloxycarbonylaziridine-2-carboxylic acid; ethyl N-ethoxycarbonyl-N-formyl-carbamate CAS Name: N-ethoxycarbonyl-N-formylcarbamic acid ethyl ester; 1-phenylmethoxycarbonyl-2-aziridinecarboxylic acid IUPAC Name: ethyl N-ethoxycarbonyl-N-formylcarbamate; 1-phenylmethoxycarbonylaziridine-2-carboxylic acid Traditional Name: N-carbethoxy-N-formyl-carbamic acid ethyl ester; 1-carbobenzoxyethylenimine-2-carboxylic acid Formula: C18H22N2O9 MolecularWeight: 410.37528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N(C=O)C(=O)OCC.C1C(N1C(=O)OCC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CCOC(=O)N(C=O)C(=O)OCC.C1C(N1C(=O)OCC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C11H11NO4.C7H11NO5/c13-10(14)9-6-12(9)11(15)16-7-8-4-2-1-3-5-8;1-3-12-6(10)8(5-9)7(11)13-4-2/h1-5,9H,6-7H2,(H,13,14);5H,3-4H2,1-2H3