5-chloranyl-1-(3-phenylpropyl)-3-prop-2-enyl-pyrazin-2-one

Systemtic Name: 5-chloranyl-1-(3-phenylpropyl)-3-prop-2-enyl-pyrazin-2-one Openeye Name: 3-allyl-5-chloro-1-(3-phenylpropyl)pyrazin-2-one CAS Name: 5-chloro-1-(3-phenylpropyl)-3-prop-2-enyl-2-pyrazinone IUPAC Name: 5-chloro-1-(3-phenylpropyl)-3-prop-2-enylpyrazin-2-one Traditional Name: 3-allyl-5-chloro-1-(3-phenylpropyl)pyrazin-2-one Formula: C16H17ClN2O MolecularWeight: 288.77198

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1=NC(=CN(C1=O)CCCC2=CC=CC=C2)Cl

Isomeric SMILES

C=CCC1=NC(=CN(C1=O)CCCC2=CC=CC=C2)Cl

InChI

InChI=1S/C16H17ClN2O/c1-2-7-14-16(20)19(12-15(17)18-14)11-6-10-13-8-4-3-5-9-13/h2-5,8-9,12H,1,6-7,10-11H2