octyl 2-azanyl-1-prop-2-enyl-pyrrolo[3,2-b]quinoxaline-3-carboxylate

Systemtic Name: octyl 2-azanyl-1-prop-2-enyl-pyrrolo[3,2-b]quinoxaline-3-carboxylate Openeye Name: octyl 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 octyl ester IUPAC Name: octyl 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 octyl ester Formula: C22H28N4O2 MolecularWeight: 380.48332

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H28N4O2/c1-3-5-6-7-8-11-15-28-22(27)18-19-21(26(14-4-2)20(18)23)25-17-13-10-9-12-16(17)24-19/h4,9-10,12-13H,2-3,5-8,11,14-15,23H2,1H3