(phenylmethyl) 2-azanyl-1-prop-2-enyl-pyrrolo[3,2-b]quinoxaline-3-carboxylate

Systemtic Name: (phenylmethyl) 2-azanyl-1-prop-2-enyl-pyrrolo[3,2-b]quinoxaline-3-carboxylate Openeye Name: benzyl 1-allyl-2-amino-pyrrolo[3,2-b]quinoxaline-3-carboxylate CAS Name: 2-amino-1-prop-2-enyl-3-pyrrolo[3,2-b]quinoxalinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-amino-1-prop-2-enylpyrrolo[3,2-b]quinoxaline-3-carboxylate Traditional Name: 1-allyl-2-amino-pyrrolo[3,2-b]quinoxaline-3-carboxylic acid benzyl ester Formula: C21H18N4O2 MolecularWeight: 358.39322

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=C(C2=NC3=CC=CC=C3N=C21)C(=O)OCC4=CC=CC=C4)N

Isomeric SMILES

C=CCN1C(=C(C2=NC3=CC=CC=C3N=C21)C(=O)OCC4=CC=CC=C4)N

InChI

InChI=1S/C21H18N4O2/c1-2-12-25-19(22)17(21(26)27-13-14-8-4-3-5-9-14)18-20(25)24-16-11-7-6-10-15(16)23-18/h2-11H,1,12-13,22H2