N-[2-[3-(4-ethoxyphenyl)-6-oxidanylidene-pyridazin-1-yl]ethyl]-9H-xanthene-9-carboxamide

Systemtic Name: N-[2-[3-(4-ethoxyphenyl)-6-oxidanylidene-pyridazin-1-yl]ethyl]-9H-xanthene-9-carboxamide Openeye Name: N-[2-[3-(4-ethoxyphenyl)-6-oxo-pyridazin-1-yl]ethyl]-9H-xanthene-9-carboxamide CAS Name: N-[2-[3-(4-ethoxyphenyl)-6-oxo-1-pyridazinyl]ethyl]-9H-xanthene-9-carboxamide IUPAC Name: N-[2-[3-(4-ethoxyphenyl)-6-oxopyridazin-1-yl]ethyl]-9H-xanthene-9-carboxamide Traditional Name: N-[2-(6-keto-3-p-phenetyl-pyridazin-1-yl)ethyl]-9H-xanthene-9-carboxamide Formula: C28H25N3O4 MolecularWeight: 467.5158

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NN(C(=O)C=C2)CCNC(=O)C3C4=CC=CC=C4OC5=CC=CC=C35

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NN(C(=O)C=C2)CCNC(=O)C3C4=CC=CC=C4OC5=CC=CC=C35

InChI

InChI=1S/C28H25N3O4/c1-2-34-20-13-11-19(12-14-20)23-15-16-26(32)31(30-23)18-17-29-28(33)27-21-7-3-5-9-24(21)35-25-10-6-4-8-22(25)27/h3-16,27H,2,17-18H2,1H3,(H,29,33)