(E)-4-[[(3Z)-3-[(2-methoxyphenyl)methylidene]-9-oxidanylidene-1,2-dihydropyrrolo[2,1-b]quinazolin-6-yl]amino]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[[(3Z)-3-[(2-methoxyphenyl)methylidene]-9-oxidanylidene-1,2-dihydropyrrolo[2,1-b]quinazolin-6-yl]amino]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[[(3Z)-3-[(2-methoxyphenyl)methylene]-9-oxo-1,2-dihydropyrrolo[2,1-b]quinazolin-6-yl]amino]-4-oxo-but-2-enoic acid CAS Name: (E)-4-[[(3Z)-3-[(2-methoxyphenyl)methylidene]-9-oxo-1,2-dihydropyrrolo[2,1-b]quinazolin-6-yl]amino]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[[(3Z)-3-[(2-methoxyphenyl)methylidene]-9-oxo-1,2-dihydropyrrolo[2,1-b]quinazolin-6-yl]amino]-4-oxobut-2-enoic acid Traditional Name: (E)-4-keto-4-[[(3Z)-9-keto-3-o-anisylidene-1,2-dihydropyrrolo[2,1-b]quinazolin-6-yl]amino]but-2-enoic acid Formula: C23H19N3O5 MolecularWeight: 417.41406

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C=C2CCN3C2=NC4=C(C3=O)C=CC(=C4)NC(=O)C=CC(=O)O

Isomeric SMILES

COC1=CC=CC=C1/C=C\2/CCN3C2=NC4=C(C3=O)C=CC(=C4)NC(=O)/C=C/C(=O)O

InChI

InChI=1S/C23H19N3O5/c1-31-19-5-3-2-4-14(19)12-15-10-11-26-22(15)25-18-13-16(6-7-17(18)23(26)30)24-20(27)8-9-21(28)29/h2-9,12-13H,10-11H2,1H3,(H,24,27)(H,28,29)/b9-8+,15-12-