(3E)-1-(phenylmethyl)-3-(1H-pyrrol-3-ylmethylidene)piperidin-4-one

Systemtic Name: (3E)-1-(phenylmethyl)-3-(1H-pyrrol-3-ylmethylidene)piperidin-4-one Openeye Name: (3E)-1-benzyl-3-(1H-pyrrol-3-ylmethylene)piperidin-4-one CAS Name: (3E)-1-(phenylmethyl)-3-(1H-pyrrol-3-ylmethylidene)-4-piperidinone IUPAC Name: (3E)-1-benzyl-3-(1H-pyrrol-3-ylmethylidene)piperidin-4-one Traditional Name: (3E)-1-benzyl-3-(1H-pyrrol-3-ylmethylene)-4-piperidone Formula: C17H18N2O MolecularWeight: 266.33762

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=CC2=CNC=C2)C1=O)CC3=CC=CC=C3

Isomeric SMILES

C1CN(C/C(=C\C2=CNC=C2)/C1=O)CC3=CC=CC=C3

InChI

InChI=1S/C17H18N2O/c20-17-7-9-19(12-14-4-2-1-3-5-14)13-16(17)10-15-6-8-18-11-15/h1-6,8,10-11,18H,7,9,12-13H2/b16-10+