2-methoxyethyl 2-azanyl-1-(3-butoxypropyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate

Systemtic Name: 2-methoxyethyl 2-azanyl-1-(3-butoxypropyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate Openeye Name: 2-methoxyethyl 2-amino-1-(3-butoxypropyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate CAS Name: 2-amino-1-(3-butoxypropyl)-3-pyrrolo[3,2-b]quinoxalinecarboxylic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl 2-amino-1-(3-butoxypropyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate Traditional Name: 2-amino-1-(3-butoxypropyl)pyrrolo[3,2-b]quinoxaline-3-carboxylic acid 2-methoxyethyl ester Formula: C21H28N4O4 MolecularWeight: 400.47142

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOCCCN1C(=C(C2=NC3=CC=CC=C3N=C21)C(=O)OCCOC)N

Isomeric SMILES

CCCCOCCCN1C(=C(C2=NC3=CC=CC=C3N=C21)C(=O)OCCOC)N

InChI

InChI=1S/C21H28N4O4/c1-3-4-11-28-12-7-10-25-19(22)17(21(26)29-14-13-27-2)18-20(25)24-16-9-6-5-8-15(16)23-18/h5-6,8-9H,3-4,7,10-14,22H2,1-2H3