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

Systemtic Name: N-[(E)-[1-(3-methylbutyl)-2-oxidanylidene-indol-3-ylidene]amino]-4-oxidanylidene-3H-phthalazine-1-carboxamide Openeye Name: N-[(E)-(1-isopentyl-2-oxo-indolin-3-ylidene)amino]-4-oxo-3H-phthalazine-1-carboxamide CAS Name: N-[(E)-[1-(3-methylbutyl)-2-oxo-3-indolylidene]amino]-4-oxo-3H-phthalazine-1-carboxamide IUPAC Name: N-[(E)-[1-(3-methylbutyl)-2-oxoindol-3-ylidene]amino]-4-oxo-3H-phthalazine-1-carboxamide Traditional Name: N-[(E)-(1-isoamyl-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:

CC(C)CCN1C2=CC=CC=C2C(=NNC(=O)C3=NNC(=O)C4=CC=CC=C43)C1=O

Isomeric SMILES

CC(C)CCN1C2=CC=CC=C2/C(=N\NC(=O)C3=NNC(=O)C4=CC=CC=C43)/C1=O

InChI

InChI=1S/C22H21N5O3/c1-13(2)11-12-27-17-10-6-5-9-16(17)19(22(27)30)24-26-21(29)18-14-7-3-4-8-15(14)20(28)25-23-18/h3-10,13H,11-12H2,1-2H3,(H,25,28)(H,26,29)/b24-19+