methyl 4-[2-(1,4-diazepan-1-yl)ethanoylamino]butanoate

Systemtic Name: methyl 4-[2-(1,4-diazepan-1-yl)ethanoylamino]butanoate Openeye Name: methyl 4-[[2-(1,4-diazepan-1-yl)acetyl]amino]butanoate CAS Name: 4-[[2-(1,4-diazepan-1-yl)-1-oxoethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[[2-(1,4-diazepan-1-yl)acetyl]amino]butanoate Traditional Name: 4-[[2-(1,4-diazepan-1-yl)acetyl]amino]butyric acid methyl ester Formula: C12H23N3O3 MolecularWeight: 257.32932

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCNC(=O)CN1CCCNCC1

Isomeric SMILES

COC(=O)CCCNC(=O)CN1CCCNCC1

InChI

InChI=1S/C12H23N3O3/c1-18-12(17)4-2-6-14-11(16)10-15-8-3-5-13-7-9-15/h13H,2-10H2,1H3,(H,14,16)