N-[4-(2-azanyl-3-ethoxycarbonyl-pyrrolo[3,2-b]quinoxalin-1-yl)phenyl]sulfonylethanimidate

Systemtic Name: N-[4-(2-azanyl-3-ethoxycarbonyl-pyrrolo[3,2-b]quinoxalin-1-yl)phenyl]sulfonylethanimidate Openeye Name: N-[4-(2-amino-3-ethoxycarbonyl-pyrrolo[3,2-b]quinoxalin-1-yl)phenyl]sulfonylethanimidate CAS Name: N-[4-(2-amino-3-ethoxycarbonyl-1-pyrrolo[3,2-b]quinoxalinyl)phenyl]sulfonylethanimidate IUPAC Name: N-[4-(2-amino-3-ethoxycarbonylpyrrolo[3,2-b]quinoxalin-1-yl)phenyl]sulfonylethanimidate Traditional Name: N-[4-(2-amino-3-carbethoxy-pyrrolo[3,2-b]quinoxalin-1-yl)phenyl]sulfonylacetimidate Formula: C21H18N5O5S- MolecularWeight: 452.46312

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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)S(=O)(=O)N=C(C)[O-])N

Isomeric SMILES

CCOC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)C4=CC=C(C=C4)S(=O)(=O)N=C(C)[O-])N

InChI

InChI=1S/C21H19N5O5S/c1-3-31-21(28)17-18-20(24-16-7-5-4-6-15(16)23-18)26(19(17)22)13-8-10-14(11-9-13)32(29,30)25-12(2)27/h4-11H,3,22H2,1-2H3,(H,25,27)/p-1