ethyl N-[[4-(pyridin-2-ylmethyl)-1,4-diazepan-1-yl]carbonyl]carbamate

Systemtic Name: ethyl N-[[4-(pyridin-2-ylmethyl)-1,4-diazepan-1-yl]carbonyl]carbamate Openeye Name: ethyl N-[4-(2-pyridylmethyl)-1,4-diazepane-1-carbonyl]carbamate CAS Name: N-[oxo-[4-(2-pyridinylmethyl)-1,4-diazepan-1-yl]methyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[4-(pyridin-2-ylmethyl)-1,4-diazepane-1-carbonyl]carbamate Traditional Name: N-[4-(2-pyridylmethyl)-1,4-diazepane-1-carbonyl]carbamic acid ethyl ester Formula: C15H22N4O3 MolecularWeight: 306.36018

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC(=O)N1CCCN(CC1)CC2=CC=CC=N2

Isomeric SMILES

CCOC(=O)NC(=O)N1CCCN(CC1)CC2=CC=CC=N2

InChI

InChI=1S/C15H22N4O3/c1-2-22-15(21)17-14(20)19-9-5-8-18(10-11-19)12-13-6-3-4-7-16-13/h3-4,6-7H,2,5,8-12H2,1H3,(H,17,20,21)