1-[4-(2-azanylethyl)-1,4-diazepan-1-yl]-3,3-dimethyl-butan-1-one

Systemtic Name: 1-[4-(2-azanylethyl)-1,4-diazepan-1-yl]-3,3-dimethyl-butan-1-one Openeye Name: 1-[4-(2-aminoethyl)-1,4-diazepan-1-yl]-3,3-dimethyl-butan-1-one CAS Name: 1-[4-(2-aminoethyl)-1,4-diazepan-1-yl]-3,3-dimethyl-1-butanone IUPAC Name: 1-[4-(2-aminoethyl)-1,4-diazepan-1-yl]-3,3-dimethylbutan-1-one Traditional Name: 1-[4-(2-aminoethyl)-1,4-diazepan-1-yl]-3,3-dimethyl-butan-1-one Formula: C13H27N3O MolecularWeight: 241.37298

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)N1CCCN(CC1)CCN

Isomeric SMILES

CC(C)(C)CC(=O)N1CCCN(CC1)CCN

InChI

InChI=1S/C13H27N3O/c1-13(2,3)11-12(17)16-7-4-6-15(8-5-14)9-10-16/h4-11,14H2,1-3H3