N-(4-ethoxy-3-methoxy-phenyl)-3-(2-methylpropyl)-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-(4-ethoxy-3-methoxy-phenyl)-3-(2-methylpropyl)-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-(4-ethoxy-3-methoxy-phenyl)-3-isobutyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-(4-ethoxy-3-methoxyphenyl)-3-(2-methylpropyl)-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-(4-ethoxy-3-methoxyphenyl)-3-(2-methylpropyl)-4-oxophthalazine-1-carboxamide Traditional Name: N-(4-ethoxy-3-methoxy-phenyl)-3-isobutyl-4-keto-phthalazine-1-carboxamide Formula: C22H25N3O4 MolecularWeight: 395.4516

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC(C)C)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC(C)C)OC

InChI

InChI=1S/C22H25N3O4/c1-5-29-18-11-10-15(12-19(18)28-4)23-21(26)20-16-8-6-7-9-17(16)22(27)25(24-20)13-14(2)3/h6-12,14H,5,13H2,1-4H3,(H,23,26)