N-[(Z)-[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]methylideneamino]-4-oxidanylidene-3H-phthalazine-1-carboxamide

Systemtic Name: N-[(Z)-[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]methylideneamino]-4-oxidanylidene-3H-phthalazine-1-carboxamide Openeye Name: N-[(Z)-[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]methyleneamino]-4-oxo-3H-phthalazine-1-carboxamide CAS Name: N-[(Z)-[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]methylideneamino]-4-oxo-3H-phthalazine-1-carboxamide IUPAC Name: N-[(Z)-[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]methylideneamino]-4-oxo-3H-phthalazine-1-carboxamide Traditional Name: N-[(Z)-[(2S)-5-ethoxy-2-methyl-coumaran-6-yl]methyleneamino]-4-keto-3H-phthalazine-1-carboxamide Formula: C21H20N4O4 MolecularWeight: 392.4079

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1C=NNC(=O)C3=NNC(=O)C4=CC=CC=C43)OC(C2)C

Isomeric SMILES

CCOC1=CC2=C(C=C1/C=N\NC(=O)C3=NNC(=O)C4=CC=CC=C43)O[C@H](C2)C

InChI

InChI=1S/C21H20N4O4/c1-3-28-17-9-13-8-12(2)29-18(13)10-14(17)11-22-24-21(27)19-15-6-4-5-7-16(15)20(26)25-23-19/h4-7,9-12H,3,8H2,1-2H3,(H,24,27)(H,25,26)/b22-11-/t12-/m0/s1