3-[(3S,6S)-1-[4-(diethylamino)but-2-ynyl]-3,6-dimethyl-4-oxidanylidene-piperidin-3-yl]propanenitrile

Systemtic Name: 3-[(3S,6S)-1-[4-(diethylamino)but-2-ynyl]-3,6-dimethyl-4-oxidanylidene-piperidin-3-yl]propanenitrile Openeye Name: 3-[(3S,6S)-1-[4-(diethylamino)but-2-ynyl]-3,6-dimethyl-4-oxo-3-piperidyl]propanenitrile CAS Name: 3-[(3S,6S)-1-[4-(diethylamino)but-2-ynyl]-3,6-dimethyl-4-oxo-3-piperidinyl]propanenitrile IUPAC Name: 3-[(3S,6S)-1-[4-(diethylamino)but-2-ynyl]-3,6-dimethyl-4-oxopiperidin-3-yl]propanenitrile Traditional Name: 3-[(3S,6S)-1-[4-(diethylamino)but-2-ynyl]-4-keto-3,6-dimethyl-3-piperidyl]propionitrile Formula: C18H29N3O MolecularWeight: 303.44236

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC#CCN1CC(C(=O)CC1C)(C)CCC#N

Isomeric SMILES

CCN(CC)CC#CCN1C[C@](C(=O)C[C@@H]1C)(C)CCC#N

InChI

InChI=1S/C18H29N3O/c1-5-20(6-2)12-7-8-13-21-15-18(4,10-9-11-19)17(22)14-16(21)3/h16H,5-6,9-10,12-15H2,1-4H3/t16-,18-/m0/s1