(6-methoxy-1H-indol-3-yl) 3-(isoquinolin-3-ylcarbonylamino)-2-oxidanylidene-propanoate

Systemtic Name: (6-methoxy-1H-indol-3-yl) 3-(isoquinolin-3-ylcarbonylamino)-2-oxidanylidene-propanoate Openeye Name: (6-methoxy-1H-indol-3-yl) 3-(isoquinoline-3-carbonylamino)-2-oxo-propanoate CAS Name: 3-[[3-isoquinolinyl(oxo)methyl]amino]-2-oxopropanoic acid (6-methoxy-1H-indol-3-yl) ester IUPAC Name: (6-methoxy-1H-indol-3-yl) 3-(isoquinoline-3-carbonylamino)-2-oxopropanoate Traditional Name: 3-(isoquinoline-3-carbonylamino)-2-keto-propionic acid (6-methoxy-1H-indol-3-yl) ester Formula: C22H17N3O5 MolecularWeight: 403.38748

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CN2)OC(=O)C(=O)CNC(=O)C3=CC4=CC=CC=C4C=N3

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CN2)OC(=O)C(=O)CNC(=O)C3=CC4=CC=CC=C4C=N3

InChI

InChI=1S/C22H17N3O5/c1-29-15-6-7-16-17(9-15)24-12-20(16)30-22(28)19(26)11-25-21(27)18-8-13-4-2-3-5-14(13)10-23-18/h2-10,12,24H,11H2,1H3,(H,25,27)