3-ethyl-3-[4-(2-nitrophenyl)but-3-ynyl]piperidin-2-one

Systemtic Name: 3-ethyl-3-[4-(2-nitrophenyl)but-3-ynyl]piperidin-2-one Openeye Name: 3-ethyl-3-[4-(2-nitrophenyl)but-3-ynyl]piperidin-2-one CAS Name: 3-ethyl-3-[4-(2-nitrophenyl)but-3-ynyl]-2-piperidinone IUPAC Name: 3-ethyl-3-[4-(2-nitrophenyl)but-3-ynyl]piperidin-2-one Traditional Name: 3-ethyl-3-[4-(2-nitrophenyl)but-3-ynyl]-2-piperidone Formula: C17H20N2O3 MolecularWeight: 300.3523

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CCCNC1=O)CCC#CC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CCC1(CCCNC1=O)CCC#CC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C17H20N2O3/c1-2-17(12-7-13-18-16(17)20)11-6-5-9-14-8-3-4-10-15(14)19(21)22/h3-4,8,10H,2,6-7,11-13H2,1H3,(H,18,20)