butyl 2-azanyl-1-(pyridin-2-ylmethyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate

Systemtic Name: butyl 2-azanyl-1-(pyridin-2-ylmethyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate Openeye Name: butyl 2-amino-1-(2-pyridylmethyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate CAS Name: 2-amino-1-(2-pyridinylmethyl)-3-pyrrolo[3,2-b]quinoxalinecarboxylic acid butyl ester IUPAC Name: butyl 2-amino-1-(pyridin-2-ylmethyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate Traditional Name: 2-amino-1-(2-pyridylmethyl)pyrrolo[3,2-b]quinoxaline-3-carboxylic acid butyl ester Formula: C21H21N5O2 MolecularWeight: 375.42374

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)CC4=CC=CC=N4)N

Isomeric SMILES

CCCCOC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)CC4=CC=CC=N4)N

InChI

InChI=1S/C21H21N5O2/c1-2-3-12-28-21(27)17-18-20(25-16-10-5-4-9-15(16)24-18)26(19(17)22)13-14-8-6-7-11-23-14/h4-11H,2-3,12-13,22H2,1H3