methyl 4-(4-azanylbutyl)-1,4-diazepane-1-carboxylate

Systemtic Name: methyl 4-(4-azanylbutyl)-1,4-diazepane-1-carboxylate Openeye Name: methyl 4-(4-aminobutyl)-1,4-diazepane-1-carboxylate CAS Name: 4-(4-aminobutyl)-1,4-diazepane-1-carboxylic acid methyl ester IUPAC Name: methyl 4-(4-aminobutyl)-1,4-diazepane-1-carboxylate Traditional Name: 4-(4-aminobutyl)-1,4-diazepane-1-carboxylic acid methyl ester Formula: C11H23N3O2 MolecularWeight: 229.31922

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N1CCCN(CC1)CCCCN

Isomeric SMILES

COC(=O)N1CCCN(CC1)CCCCN

InChI

InChI=1S/C11H23N3O2/c1-16-11(15)14-8-4-7-13(9-10-14)6-3-2-5-12/h2-10,12H2,1H3