3-butyl-N-[(Z)-2,3-dihydrochromen-4-ylideneamino]-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-butyl-N-[(Z)-2,3-dihydrochromen-4-ylideneamino]-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-butyl-N-[(Z)-chroman-4-ylideneamino]-4-oxo-phthalazine-1-carboxamide CAS Name: 3-butyl-N-[(Z)-3,4-dihydro-2H-1-benzopyran-4-ylideneamino]-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-butyl-N-[(Z)-2,3-dihydrochromen-4-ylideneamino]-4-oxophthalazine-1-carboxamide Traditional Name: 3-butyl-N-[(Z)-chroman-4-ylideneamino]-4-keto-phthalazine-1-carboxamide Formula: C22H22N4O3 MolecularWeight: 390.43508

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NN=C3CCOC4=CC=CC=C34

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N/N=C\3/CCOC4=CC=CC=C34

InChI

InChI=1S/C22H22N4O3/c1-2-3-13-26-22(28)16-9-5-4-8-15(16)20(25-26)21(27)24-23-18-12-14-29-19-11-7-6-10-17(18)19/h4-11H,2-3,12-14H2,1H3,(H,24,27)/b23-18-