3-methylbutyl 4-[2-(butylamino)ethyl]piperazine-1-carboxylate

Systemtic Name: 3-methylbutyl 4-[2-(butylamino)ethyl]piperazine-1-carboxylate Openeye Name: isopentyl 4-[2-(butylamino)ethyl]piperazine-1-carboxylate CAS Name: 4-[2-(butylamino)ethyl]-1-piperazinecarboxylic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl 4-[2-(butylamino)ethyl]piperazine-1-carboxylate Traditional Name: 4-[2-(butylamino)ethyl]piperazine-1-carboxylic acid isoamyl ester Formula: C16H33N3O2 MolecularWeight: 299.45212

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNCCN1CCN(CC1)C(=O)OCCC(C)C

Isomeric SMILES

CCCCNCCN1CCN(CC1)C(=O)OCCC(C)C

InChI

InChI=1S/C16H33N3O2/c1-4-5-7-17-8-9-18-10-12-19(13-11-18)16(20)21-14-6-15(2)3/h15,17H,4-14H2,1-3H3