pentyl 2-(propanoylamino)-1-prop-2-enyl-pyrrolo[3,2-b]quinoxaline-3-carboxylate

Systemtic Name: pentyl 2-(propanoylamino)-1-prop-2-enyl-pyrrolo[3,2-b]quinoxaline-3-carboxylate Openeye Name: pentyl 1-allyl-2-(propanoylamino)pyrrolo[3,2-b]quinoxaline-3-carboxylate CAS Name: 2-(1-oxopropylamino)-1-prop-2-enyl-3-pyrrolo[3,2-b]quinoxalinecarboxylic acid pentyl ester IUPAC Name: pentyl 2-(propanoylamino)-1-prop-2-enylpyrrolo[3,2-b]quinoxaline-3-carboxylate Traditional Name: 1-allyl-2-propionamido-pyrrolo[3,2-b]quinoxaline-3-carboxylic acid amyl ester Formula: C22H26N4O3 MolecularWeight: 394.46684

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)CC=C)NC(=O)CC

Isomeric SMILES

CCCCCOC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)CC=C)NC(=O)CC

InChI

InChI=1S/C22H26N4O3/c1-4-7-10-14-29-22(28)18-19-21(24-16-12-9-8-11-15(16)23-19)26(13-5-2)20(18)25-17(27)6-3/h5,8-9,11-12H,2,4,6-7,10,13-14H2,1,3H3,(H,25,27)