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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C2=NC3=CC=CC=C3N=C21)C(=O)OCCC(C)C)N

Isomeric SMILES

CCCCN1C(=C(C2=NC3=CC=CC=C3N=C21)C(=O)OCCC(C)C)N

InChI

InChI=1S/C20H26N4O2/c1-4-5-11-24-18(21)16(20(25)26-12-10-13(2)3)17-19(24)23-15-9-7-6-8-14(15)22-17/h6-9,13H,4-5,10-12,21H2,1-3H3