ethanedioic acid; ethyl 4-[2-(cyclooctylamino)ethanoyl]piperazine-1-carboxylate

Systemtic Name: ethanedioic acid; ethyl 4-[2-(cyclooctylamino)ethanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-(cyclooctylamino)acetyl]piperazine-1-carboxylate; oxalic acid CAS Name: 4-[2-(cyclooctylamino)-1-oxoethyl]-1-piperazinecarboxylic acid ethyl ester; oxalic acid IUPAC Name: ethyl 4-[2-(cyclooctylamino)acetyl]piperazine-1-carboxylate; oxalic acid Traditional Name: 4-[2-(cyclooctylamino)acetyl]piperazine-1-carboxylic acid ethyl ester; oxalic acid Formula: C19H33N3O7 MolecularWeight: 415.48122

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)CNC2CCCCCCC2.C(=O)(C(=O)O)O

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)CNC2CCCCCCC2.C(=O)(C(=O)O)O

InChI

InChI=1S/C17H31N3O3.C2H2O4/c1-2-23-17(22)20-12-10-19(11-13-20)16(21)14-18-15-8-6-4-3-5-7-9-15;3-1(4)2(5)6/h15,18H,2-14H2,1H3;(H,3,4)(H,5,6)