3-[4-(2-methylpropyl)-7-oxidanylidene-1,4-diazepan-1-yl]propanenitrile

Systemtic Name: 3-[4-(2-methylpropyl)-7-oxidanylidene-1,4-diazepan-1-yl]propanenitrile Openeye Name: 3-(4-isobutyl-7-oxo-1,4-diazepan-1-yl)propanenitrile CAS Name: 3-[4-(2-methylpropyl)-7-oxo-1,4-diazepan-1-yl]propanenitrile IUPAC Name: 3-[4-(2-methylpropyl)-7-oxo-1,4-diazepan-1-yl]propanenitrile Traditional Name: 3-(4-isobutyl-7-keto-1,4-diazepan-1-yl)propionitrile Formula: C12H21N3O MolecularWeight: 223.31464

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1CCC(=O)N(CC1)CCC#N

Isomeric SMILES

CC(C)CN1CCC(=O)N(CC1)CCC#N

InChI

InChI=1S/C12H21N3O/c1-11(2)10-14-7-4-12(16)15(9-8-14)6-3-5-13/h11H,3-4,6-10H2,1-2H3