4-oxidanylidene-N-[(E)-(2-oxidanylidene-1-pentyl-indol-3-ylidene)amino]-3H-phthalazine-1-carboxamide

Systemtic Name: 4-oxidanylidene-N-[(E)-(2-oxidanylidene-1-pentyl-indol-3-ylidene)amino]-3H-phthalazine-1-carboxamide Openeye Name: 4-oxo-N-[(E)-(2-oxo-1-pentyl-indolin-3-ylidene)amino]-3H-phthalazine-1-carboxamide CAS Name: 4-oxo-N-[(E)-(2-oxo-1-pentyl-3-indolylidene)amino]-3H-phthalazine-1-carboxamide IUPAC Name: 4-oxo-N-[(E)-(2-oxo-1-pentylindol-3-ylidene)amino]-3H-phthalazine-1-carboxamide Traditional Name: N-[(E)-(1-amyl-2-keto-indolin-3-ylidene)amino]-4-keto-3H-phthalazine-1-carboxamide Formula: C22H21N5O3 MolecularWeight: 403.43384

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C2=CC=CC=C2C(=NNC(=O)C3=NNC(=O)C4=CC=CC=C43)C1=O

Isomeric SMILES

CCCCCN1C2=CC=CC=C2/C(=N\NC(=O)C3=NNC(=O)C4=CC=CC=C43)/C1=O

InChI

InChI=1S/C22H21N5O3/c1-2-3-8-13-27-17-12-7-6-11-16(17)19(22(27)30)24-26-21(29)18-14-9-4-5-10-15(14)20(28)25-23-18/h4-7,9-12H,2-3,8,13H2,1H3,(H,25,28)(H,26,29)/b24-19+