2-[[4-(2-azanyl-3-ethoxycarbonyl-pyrrolo[3,2-b]quinoxalin-1-yl)phenyl]carbonylamino]ethanoic acid

Systemtic Name: 2-[[4-(2-azanyl-3-ethoxycarbonyl-pyrrolo[3,2-b]quinoxalin-1-yl)phenyl]carbonylamino]ethanoic acid Openeye Name: 2-[[4-(2-amino-3-ethoxycarbonyl-pyrrolo[3,2-b]quinoxalin-1-yl)benzoyl]amino]acetic acid CAS Name: 2-[[[4-(2-amino-3-ethoxycarbonyl-1-pyrrolo[3,2-b]quinoxalinyl)phenyl]-oxomethyl]amino]acetic acid IUPAC Name: 2-[[4-(2-amino-3-ethoxycarbonylpyrrolo[3,2-b]quinoxalin-1-yl)benzoyl]amino]acetic acid Traditional Name: 2-[[4-(2-amino-3-carbethoxy-pyrrolo[3,2-b]quinoxalin-1-yl)benzoyl]amino]acetic acid Formula: C22H19N5O5 MolecularWeight: 433.41676

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)C4=CC=C(C=C4)C(=O)NCC(=O)O)N

Isomeric SMILES

CCOC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)C4=CC=C(C=C4)C(=O)NCC(=O)O)N

InChI

InChI=1S/C22H19N5O5/c1-2-32-22(31)17-18-20(26-15-6-4-3-5-14(15)25-18)27(19(17)23)13-9-7-12(8-10-13)21(30)24-11-16(28)29/h3-10H,2,11,23H2,1H3,(H,24,30)(H,28,29)