pentyl 2-azanyl-1-butyl-pyrrolo[3,2-b]quinoxaline-3-carboxylate

Systemtic Name: pentyl 2-azanyl-1-butyl-pyrrolo[3,2-b]quinoxaline-3-carboxylate Openeye Name: pentyl 2-amino-1-butyl-pyrrolo[3,2-b]quinoxaline-3-carboxylate CAS Name: 2-amino-1-butyl-3-pyrrolo[3,2-b]quinoxalinecarboxylic acid pentyl ester IUPAC Name: pentyl 2-amino-1-butylpyrrolo[3,2-b]quinoxaline-3-carboxylate Traditional Name: 2-amino-1-butyl-pyrrolo[3,2-b]quinoxaline-3-carboxylic acid amyl ester Formula: C20H26N4O2 MolecularWeight: 354.44604

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H26N4O2/c1-3-5-9-13-26-20(25)16-17-19(24(18(16)21)12-6-4-2)23-15-11-8-7-10-14(15)22-17/h7-8,10-11H,3-6,9,12-13,21H2,1-2H3