2-ethylbutyl 2-azanyl-1-(4-butoxycarbonylphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate

Systemtic Name: 2-ethylbutyl 2-azanyl-1-(4-butoxycarbonylphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate Openeye Name: 2-ethylbutyl 2-amino-1-(4-butoxycarbonylphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate CAS Name: 2-amino-1-[4-[butoxy(oxo)methyl]phenyl]-3-pyrrolo[3,2-b]quinoxalinecarboxylic acid 2-ethylbutyl ester IUPAC Name: 2-ethylbutyl 2-amino-1-(4-butoxycarbonylphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate Traditional Name: 2-amino-1-(4-butoxycarbonylphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylic acid 2-ethylbutyl ester Formula: C28H32N4O4 MolecularWeight: 488.57808

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)N2C(=C(C3=NC4=CC=CC=C4N=C32)C(=O)OCC(CC)CC)N

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)N2C(=C(C3=NC4=CC=CC=C4N=C32)C(=O)OCC(CC)CC)N

InChI

InChI=1S/C28H32N4O4/c1-4-7-16-35-27(33)19-12-14-20(15-13-19)32-25(29)23(28(34)36-17-18(5-2)6-3)24-26(32)31-22-11-9-8-10-21(22)30-24/h8-15,18H,4-7,16-17,29H2,1-3H3