tert-butyl N-(2-piperazin-1-ylethyl)-N-(pyridin-3-ylmethyl)carbamate

Systemtic Name: tert-butyl N-(2-piperazin-1-ylethyl)-N-(pyridin-3-ylmethyl)carbamate Openeye Name: tert-butyl N-(2-piperazin-1-ylethyl)-N-(3-pyridylmethyl)carbamate CAS Name: N-[2-(1-piperazinyl)ethyl]-N-(3-pyridinylmethyl)carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-(2-piperazin-1-ylethyl)-N-(pyridin-3-ylmethyl)carbamate Traditional Name: N-(2-piperazinoethyl)-N-(3-pyridylmethyl)carbamic acid tert-butyl ester Formula: C17H28N4O2 MolecularWeight: 320.42982

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(CCN1CCNCC1)CC2=CN=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)N(CCN1CCNCC1)CC2=CN=CC=C2

InChI

InChI=1S/C17H28N4O2/c1-17(2,3)23-16(22)21(14-15-5-4-6-19-13-15)12-11-20-9-7-18-8-10-20/h4-6,13,18H,7-12,14H2,1-3H3