5-chloranyl-3-(3-ethoxyphenyl)-1-(3-phenylpropyl)pyrazin-2-one

Systemtic Name: 5-chloranyl-3-(3-ethoxyphenyl)-1-(3-phenylpropyl)pyrazin-2-one Openeye Name: 5-chloro-3-(3-ethoxyphenyl)-1-(3-phenylpropyl)pyrazin-2-one CAS Name: 5-chloro-3-(3-ethoxyphenyl)-1-(3-phenylpropyl)-2-pyrazinone IUPAC Name: 5-chloro-3-(3-ethoxyphenyl)-1-(3-phenylpropyl)pyrazin-2-one Traditional Name: 5-chloro-3-m-phenetyl-1-(3-phenylpropyl)pyrazin-2-one Formula: C21H21ClN2O2 MolecularWeight: 368.85664

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)C2=NC(=CN(C2=O)CCCC3=CC=CC=C3)Cl

Isomeric SMILES

CCOC1=CC=CC(=C1)C2=NC(=CN(C2=O)CCCC3=CC=CC=C3)Cl

InChI

InChI=1S/C21H21ClN2O2/c1-2-26-18-12-6-11-17(14-18)20-21(25)24(15-19(22)23-20)13-7-10-16-8-4-3-5-9-16/h3-6,8-9,11-12,14-15H,2,7,10,13H2,1H3