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

Systemtic Name: 1-[4-(2-azanylethyl)-1,4-diazepan-1-yl]-3-methyl-butan-1-one Openeye Name: 1-[4-(2-aminoethyl)-1,4-diazepan-1-yl]-3-methyl-butan-1-one CAS Name: 1-[4-(2-aminoethyl)-1,4-diazepan-1-yl]-3-methyl-1-butanone IUPAC Name: 1-[4-(2-aminoethyl)-1,4-diazepan-1-yl]-3-methylbutan-1-one Traditional Name: 1-[4-(2-aminoethyl)-1,4-diazepan-1-yl]-3-methyl-butan-1-one Formula: C12H25N3O MolecularWeight: 227.3464

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H25N3O/c1-11(2)10-12(16)15-6-3-5-14(7-4-13)8-9-15/h11H,3-10,13H2,1-2H3