(E)-3-phenyl-1-(8-propanoyl-3,8-diazabicyclo[3.2.1]octan-3-yl)prop-2-en-1-one

Systemtic Name: (E)-3-phenyl-1-(8-propanoyl-3,8-diazabicyclo[3.2.1]octan-3-yl)prop-2-en-1-one Openeye Name: (E)-3-phenyl-1-(8-propanoyl-3,8-diazabicyclo[3.2.1]octan-3-yl)prop-2-en-1-one CAS Name: (E)-1-[8-(1-oxopropyl)-3,8-diazabicyclo[3.2.1]octan-3-yl]-3-phenyl-2-propen-1-one IUPAC Name: (E)-3-phenyl-1-(8-propanoyl-3,8-diazabicyclo[3.2.1]octan-3-yl)prop-2-en-1-one Traditional Name: (E)-3-phenyl-1-(8-propionyl-3,8-diazabicyclo[3.2.1]octan-3-yl)prop-2-en-1-one Formula: C18H22N2O2 MolecularWeight: 298.37948

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1C2CCC1CN(C2)C(=O)C=CC3=CC=CC=C3

Isomeric SMILES

CCC(=O)N1C2CCC1CN(C2)C(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C18H22N2O2/c1-2-17(21)20-15-9-10-16(20)13-19(12-15)18(22)11-8-14-6-4-3-5-7-14/h3-8,11,15-16H,2,9-10,12-13H2,1H3/b11-8+