methyl 1-oxidanylidene-2-[2-(2-oxidanylidene-1,3-benzoxazol-3-yl)ethanoylamino]isoquinoline-4-carboxylate

Systemtic Name: methyl 1-oxidanylidene-2-[2-(2-oxidanylidene-1,3-benzoxazol-3-yl)ethanoylamino]isoquinoline-4-carboxylate Openeye Name: methyl 1-oxo-2-[[2-(2-oxo-1,3-benzoxazol-3-yl)acetyl]amino]isoquinoline-4-carboxylate CAS Name: 1-oxo-2-[[1-oxo-2-(2-oxo-1,3-benzoxazol-3-yl)ethyl]amino]-4-isoquinolinecarboxylic acid methyl ester IUPAC Name: methyl 1-oxo-2-[[2-(2-oxo-1,3-benzoxazol-3-yl)acetyl]amino]isoquinoline-4-carboxylate Traditional Name: 1-keto-2-[[2-(2-keto-1,3-benzoxazol-3-yl)acetyl]amino]isoquinoline-4-carboxylic acid methyl ester Formula: C20H15N3O6 MolecularWeight: 393.3496

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN(C(=O)C2=CC=CC=C21)NC(=O)CN3C4=CC=CC=C4OC3=O

Isomeric SMILES

COC(=O)C1=CN(C(=O)C2=CC=CC=C21)NC(=O)CN3C4=CC=CC=C4OC3=O

InChI

InChI=1S/C20H15N3O6/c1-28-19(26)14-10-23(18(25)13-7-3-2-6-12(13)14)21-17(24)11-22-15-8-4-5-9-16(15)29-20(22)27/h2-10H,11H2,1H3,(H,21,24)