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

Systemtic Name: 2-ethylbutyl 2-azanyl-1-(4-propoxycarbonylphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate Openeye Name: 2-ethylbutyl 2-amino-1-(4-propoxycarbonylphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate CAS Name: 2-amino-1-[4-[oxo(propoxy)methyl]phenyl]-3-pyrrolo[3,2-b]quinoxalinecarboxylic acid 2-ethylbutyl ester IUPAC Name: 2-ethylbutyl 2-amino-1-(4-propoxycarbonylphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate Traditional Name: 2-amino-1-(4-propoxycarbonylphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylic acid 2-ethylbutyl ester Formula: C27H30N4O4 MolecularWeight: 474.5515

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H30N4O4/c1-4-15-34-26(32)18-11-13-19(14-12-18)31-24(28)22(27(33)35-16-17(5-2)6-3)23-25(31)30-21-10-8-7-9-20(21)29-23/h7-14,17H,4-6,15-16,28H2,1-3H3