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

Systemtic Name: N-[(Z)-[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]methylideneamino]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-[(Z)-[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]methyleneamino]-3-methyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[(Z)-[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]methylideneamino]-3-methyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-[(Z)-[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]methylideneamino]-3-methyl-4-oxophthalazine-1-carboxamide Traditional Name: N-[(Z)-[(2S)-5-ethoxy-2-methyl-coumaran-6-yl]methyleneamino]-4-keto-3-methyl-phthalazine-1-carboxamide Formula: C22H22N4O4 MolecularWeight: 406.43448

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22N4O4/c1-4-29-18-10-14-9-13(2)30-19(14)11-15(18)12-23-24-21(27)20-16-7-5-6-8-17(16)22(28)26(3)25-20/h5-8,10-13H,4,9H2,1-3H3,(H,24,27)/b23-12-/t13-/m0/s1