ethyl 2-[5-(3-cycloheptyl-4-oxidanylidene-4a,5,8,8a-tetrahydrophthalazin-1-yl)-2-methoxy-phenoxy]ethanoate

Systemtic Name: ethyl 2-[5-(3-cycloheptyl-4-oxidanylidene-4a,5,8,8a-tetrahydrophthalazin-1-yl)-2-methoxy-phenoxy]ethanoate Openeye Name: ethyl 2-[5-(3-cycloheptyl-4-oxo-4a,5,8,8a-tetrahydrophthalazin-1-yl)-2-methoxy-phenoxy]acetate CAS Name: 2-[5-(3-cycloheptyl-4-oxo-4a,5,8,8a-tetrahydrophthalazin-1-yl)-2-methoxyphenoxy]acetic acid ethyl ester IUPAC Name: ethyl 2-[5-(3-cycloheptyl-4-oxo-4a,5,8,8a-tetrahydrophthalazin-1-yl)-2-methoxyphenoxy]acetate Traditional Name: 2-[5-(3-cycloheptyl-4-keto-4a,5,8,8a-tetrahydrophthalazin-1-yl)-2-methoxy-phenoxy]acetic acid ethyl ester Formula: C26H34N2O5 MolecularWeight: 454.55856

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)COC1=C(C=CC(=C1)C2=NN(C(=O)C3C2CC=CC3)C4CCCCCC4)OC

Isomeric SMILES

CCOC(=O)COC1=C(C=CC(=C1)C2=NN(C(=O)C3C2CC=CC3)C4CCCCCC4)OC

InChI

InChI=1S/C26H34N2O5/c1-3-32-24(29)17-33-23-16-18(14-15-22(23)31-2)25-20-12-8-9-13-21(20)26(30)28(27-25)19-10-6-4-5-7-11-19/h8-9,14-16,19-21H,3-7,10-13,17H2,1-2H3