N-[(Z)-[4-(cyanomethoxy)-3-methoxy-phenyl]methylideneamino]-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide

Systemtic Name: N-[(Z)-[4-(cyanomethoxy)-3-methoxy-phenyl]methylideneamino]-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide Openeye Name: N-[(Z)-[4-(cyanomethoxy)-3-methoxy-phenyl]methyleneamino]-4-oxo-3-propyl-phthalazine-1-carboxamide CAS Name: N-[(Z)-[4-(cyanomethoxy)-3-methoxyphenyl]methylideneamino]-4-oxo-3-propyl-1-phthalazinecarboxamide IUPAC Name: N-[(Z)-[4-(cyanomethoxy)-3-methoxyphenyl]methylideneamino]-4-oxo-3-propylphthalazine-1-carboxamide Traditional Name: N-[(Z)-[4-(cyanomethoxy)-3-methoxy-benzylidene]amino]-4-keto-3-propyl-phthalazine-1-carboxamide Formula: C22H21N5O4 MolecularWeight: 419.43324

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NN=CC3=CC(=C(C=C3)OCC#N)OC

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N/N=C\C3=CC(=C(C=C3)OCC#N)OC

InChI

InChI=1S/C22H21N5O4/c1-3-11-27-22(29)17-7-5-4-6-16(17)20(26-27)21(28)25-24-14-15-8-9-18(31-12-10-23)19(13-15)30-2/h4-9,13-14H,3,11-12H2,1-2H3,(H,25,28)/b24-14-