N-(1,3-benzodioxol-5-yl)-3-[7-chloranyl-3-oxidanylidene-4-(phenylmethyl)quinoxalin-2-yl]propanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-3-[7-chloranyl-3-oxidanylidene-4-(phenylmethyl)quinoxalin-2-yl]propanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-3-(4-benzyl-7-chloro-3-oxo-quinoxalin-2-yl)propanamide CAS Name: N-(1,3-benzodioxol-5-yl)-3-[7-chloro-3-oxo-4-(phenylmethyl)-2-quinoxalinyl]propanamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-3-(4-benzyl-7-chloro-3-oxoquinoxalin-2-yl)propanamide Traditional Name: N-(1,3-benzodioxol-5-yl)-3-(4-benzyl-7-chloro-3-keto-quinoxalin-2-yl)propionamide Formula: C25H20ClN3O4 MolecularWeight: 461.897

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC(=O)CCC3=NC4=C(C=CC(=C4)Cl)N(C3=O)CC5=CC=CC=C5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC(=O)CCC3=NC4=C(C=CC(=C4)Cl)N(C3=O)CC5=CC=CC=C5

InChI

InChI=1S/C25H20ClN3O4/c26-17-6-9-21-20(12-17)28-19(25(31)29(21)14-16-4-2-1-3-5-16)8-11-24(30)27-18-7-10-22-23(13-18)33-15-32-22/h1-7,9-10,12-13H,8,11,14-15H2,(H,27,30)