5-chloranyl-3-[(4-methoxyphenyl)methyl]-1-(3-phenylpropyl)pyrazin-2-one

Systemtic Name: 5-chloranyl-3-[(4-methoxyphenyl)methyl]-1-(3-phenylpropyl)pyrazin-2-one Openeye Name: 5-chloro-3-[(4-methoxyphenyl)methyl]-1-(3-phenylpropyl)pyrazin-2-one CAS Name: 5-chloro-3-[(4-methoxyphenyl)methyl]-1-(3-phenylpropyl)-2-pyrazinone IUPAC Name: 5-chloro-3-[(4-methoxyphenyl)methyl]-1-(3-phenylpropyl)pyrazin-2-one Traditional Name: 5-chloro-3-p-anisyl-1-(3-phenylpropyl)pyrazin-2-one Formula: C21H21ClN2O2 MolecularWeight: 368.85664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC2=NC(=CN(C2=O)CCCC3=CC=CC=C3)Cl

Isomeric SMILES

COC1=CC=C(C=C1)CC2=NC(=CN(C2=O)CCCC3=CC=CC=C3)Cl

InChI

InChI=1S/C21H21ClN2O2/c1-26-18-11-9-17(10-12-18)14-19-21(25)24(15-20(22)23-19)13-5-8-16-6-3-2-4-7-16/h2-4,6-7,9-12,15H,5,8,13-14H2,1H3