methyl 2-azanyl-1-(1-oxidanylbutan-2-yl)pyrrolo[3,2-b]quinoxaline-3-carboxylate

Systemtic Name: methyl 2-azanyl-1-(1-oxidanylbutan-2-yl)pyrrolo[3,2-b]quinoxaline-3-carboxylate Openeye Name: methyl 2-amino-1-[1-(hydroxymethyl)propyl]pyrrolo[3,2-b]quinoxaline-3-carboxylate CAS Name: 2-amino-1-(1-hydroxybutan-2-yl)-3-pyrrolo[3,2-b]quinoxalinecarboxylic acid methyl ester IUPAC Name: methyl 2-amino-1-(1-hydroxybutan-2-yl)pyrrolo[3,2-b]quinoxaline-3-carboxylate Traditional Name: 2-amino-1-(1-methylolpropyl)pyrrolo[3,2-b]quinoxaline-3-carboxylic acid methyl ester Formula: C16H18N4O3 MolecularWeight: 314.33912

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)N1C(=C(C2=NC3=CC=CC=C3N=C21)C(=O)OC)N

Isomeric SMILES

CCC(CO)N1C(=C(C2=NC3=CC=CC=C3N=C21)C(=O)OC)N

InChI

InChI=1S/C16H18N4O3/c1-3-9(8-21)20-14(17)12(16(22)23-2)13-15(20)19-11-7-5-4-6-10(11)18-13/h4-7,9,21H,3,8,17H2,1-2H3