(2R,3R,4S)-3-ethyl-4-(1H-indol-2-ylcarbonyl)-1-methyl-3-oxidanyl-piperidine-2-carbonitrile

Systemtic Name: (2R,3R,4S)-3-ethyl-4-(1H-indol-2-ylcarbonyl)-1-methyl-3-oxidanyl-piperidine-2-carbonitrile Openeye Name: (2R,3R,4S)-3-ethyl-3-hydroxy-4-(1H-indole-2-carbonyl)-1-methyl-piperidine-2-carbonitrile CAS Name: (2R,3R,4S)-3-ethyl-3-hydroxy-4-[1H-indol-2-yl(oxo)methyl]-1-methyl-2-piperidinecarbonitrile IUPAC Name: (2R,3R,4S)-3-ethyl-3-hydroxy-4-(1H-indole-2-carbonyl)-1-methylpiperidine-2-carbonitrile Traditional Name: (2R,3R,4S)-3-ethyl-3-hydroxy-4-(1H-indole-2-carbonyl)-1-methyl-pipecolinonitrile Formula: C18H21N3O2 MolecularWeight: 311.37824

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(CCN(C1C#N)C)C(=O)C2=CC3=CC=CC=C3N2)O

Isomeric SMILES

CC[C@]1([C@H](CCN([C@@H]1C#N)C)C(=O)C2=CC3=CC=CC=C3N2)O

InChI

InChI=1S/C18H21N3O2/c1-3-18(23)13(8-9-21(2)16(18)11-19)17(22)15-10-12-6-4-5-7-14(12)20-15/h4-7,10,13,16,20,23H,3,8-9H2,1-2H3/t13-,16-,18-/m1/s1