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

Systemtic Name: pentyl 1-phenethyl-2-(propanoylamino)pyrrolo[3,2-b]quinoxaline-3-carboxylate Openeye Name: pentyl 1-phenethyl-2-(propanoylamino)pyrrolo[3,2-b]quinoxaline-3-carboxylate CAS Name: 2-(1-oxopropylamino)-1-phenethyl-3-pyrrolo[3,2-b]quinoxalinecarboxylic acid pentyl ester IUPAC Name: pentyl 1-phenethyl-2-(propanoylamino)pyrrolo[3,2-b]quinoxaline-3-carboxylate Traditional Name: 1-phenethyl-2-propionamido-pyrrolo[3,2-b]quinoxaline-3-carboxylic acid amyl ester Formula: C27H30N4O3 MolecularWeight: 458.5521

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)CCC4=CC=CC=C4)NC(=O)CC

Isomeric SMILES

CCCCCOC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)CCC4=CC=CC=C4)NC(=O)CC

InChI

InChI=1S/C27H30N4O3/c1-3-5-11-18-34-27(33)23-24-26(29-21-15-10-9-14-20(21)28-24)31(25(23)30-22(32)4-2)17-16-19-12-7-6-8-13-19/h6-10,12-15H,3-5,11,16-18H2,1-2H3,(H,30,32)