3-[7-chloranyl-3-oxidanylidene-4-(phenylmethyl)quinoxalin-2-yl]-N-prop-2-enyl-propanamide

Systemtic Name: 3-[7-chloranyl-3-oxidanylidene-4-(phenylmethyl)quinoxalin-2-yl]-N-prop-2-enyl-propanamide Openeye Name: N-allyl-3-(4-benzyl-7-chloro-3-oxo-quinoxalin-2-yl)propanamide CAS Name: 3-[7-chloro-3-oxo-4-(phenylmethyl)-2-quinoxalinyl]-N-prop-2-enylpropanamide IUPAC Name: 3-(4-benzyl-7-chloro-3-oxoquinoxalin-2-yl)-N-prop-2-enylpropanamide Traditional Name: N-allyl-3-(4-benzyl-7-chloro-3-keto-quinoxalin-2-yl)propionamide Formula: C21H20ClN3O2 MolecularWeight: 381.8554

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)CCC1=NC2=C(C=CC(=C2)Cl)N(C1=O)CC3=CC=CC=C3

Isomeric SMILES

C=CCNC(=O)CCC1=NC2=C(C=CC(=C2)Cl)N(C1=O)CC3=CC=CC=C3

InChI

InChI=1S/C21H20ClN3O2/c1-2-12-23-20(26)11-9-17-21(27)25(14-15-6-4-3-5-7-15)19-10-8-16(22)13-18(19)24-17/h2-8,10,13H,1,9,11-12,14H2,(H,23,26)