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(3S)-5-methyl-3-(7-oxidanylidene-4-phenethyl-1,4-diazepan-1-yl)hexanenitrile

(3S)-5-methyl-3-(7-oxidanylidene-4-phenethyl-1,4-diazepan-1-yl)hexanenitrile

Systemtic Name:(3S)-5-methyl-3-(7-oxidanylidene-4-phenethyl-1,4-diazepan-1-yl)hexanenitrile
Openeye Name:(3S)-5-methyl-3-(7-oxo-4-phenethyl-1,4-diazepan-1-yl)hexanenitrile
CAS Name:(3S)-5-methyl-3-(7-oxo-4-phenethyl-1,4-diazepan-1-yl)hexanenitrile
IUPAC Name:(3S)-5-methyl-3-(7-oxo-4-phenethyl-1,4-diazepan-1-yl)hexanenitrile
Traditional Name:(3S)-3-(7-keto-4-phenethyl-1,4-diazepan-1-yl)-5-methyl-hexanenitrile
Formula: C20H29N3O
MolecularWeight: 327.46376
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CC#N)N1CCN(CCC1=O)CCC2=CC=CC=C2


Isomeric SMILES

CC(C)C[C@@H](CC#N)N1CCN(CCC1=O)CCC2=CC=CC=C2


InChI

InChI=1S/C20H29N3O/c1-17(2)16-19(8-11-21)23-15-14-22(13-10-20(23)24)12-9-18-6-4-3-5-7-18/h3-7,17,19H,8-10,12-16H2,1-2H3/t19-/m1/s1


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