4-oxidanylidene-N-[(Z)-1-(4-piperidin-1-ylphenyl)ethylideneamino]-3H-phthalazine-1-carboxamide

Systemtic Name: 4-oxidanylidene-N-[(Z)-1-(4-piperidin-1-ylphenyl)ethylideneamino]-3H-phthalazine-1-carboxamide Openeye Name: 4-oxo-N-[(Z)-1-[4-(1-piperidyl)phenyl]ethylideneamino]-3H-phthalazine-1-carboxamide CAS Name: 4-oxo-N-[(Z)-1-[4-(1-piperidinyl)phenyl]ethylideneamino]-3H-phthalazine-1-carboxamide IUPAC Name: 4-oxo-N-[(Z)-1-(4-piperidin-1-ylphenyl)ethylideneamino]-3H-phthalazine-1-carboxamide Traditional Name: 4-keto-N-[(Z)-1-(4-piperidinophenyl)ethylideneamino]-3H-phthalazine-1-carboxamide Formula: C22H23N5O2 MolecularWeight: 389.45032

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=NNC(=O)C2=CC=CC=C21)C3=CC=C(C=C3)N4CCCCC4

Isomeric SMILES

C/C(=N/NC(=O)C1=NNC(=O)C2=CC=CC=C21)/C3=CC=C(C=C3)N4CCCCC4

InChI

InChI=1S/C22H23N5O2/c1-15(16-9-11-17(12-10-16)27-13-5-2-6-14-27)23-26-22(29)20-18-7-3-4-8-19(18)21(28)25-24-20/h3-4,7-12H,2,5-6,13-14H2,1H3,(H,25,28)(H,26,29)/b23-15-