4-chloranyl-N-(3-cyano-1-prop-2-enyl-pyrrolo[3,2-b]quinoxalin-2-yl)benzamide

Systemtic Name: 4-chloranyl-N-(3-cyano-1-prop-2-enyl-pyrrolo[3,2-b]quinoxalin-2-yl)benzamide Openeye Name: N-(1-allyl-3-cyano-pyrrolo[3,2-b]quinoxalin-2-yl)-4-chloro-benzamide CAS Name: 4-chloro-N-(3-cyano-1-prop-2-enyl-2-pyrrolo[3,2-b]quinoxalinyl)benzamide IUPAC Name: 4-chloro-N-(3-cyano-1-prop-2-enylpyrrolo[3,2-b]quinoxalin-2-yl)benzamide Traditional Name: N-(1-allyl-3-cyano-pyrrolo[3,2-b]quinoxalin-2-yl)-4-chloro-benzamide Formula: C21H14ClN5O MolecularWeight: 387.82176

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=C(C2=NC3=CC=CC=C3N=C21)C#N)NC(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C=CCN1C(=C(C2=NC3=CC=CC=C3N=C21)C#N)NC(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H14ClN5O/c1-2-11-27-19(26-21(28)13-7-9-14(22)10-8-13)15(12-23)18-20(27)25-17-6-4-3-5-16(17)24-18/h2-10H,1,11H2,(H,26,28)