2-[[(E)-(2-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]amino]-4-(phenylmethyl)phthalazin-1-one

Systemtic Name: 2-[[(E)-(2-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]amino]-4-(phenylmethyl)phthalazin-1-one Openeye Name: 4-benzyl-2-[[(E)-(2-hydroxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)methyl]amino]phthalazin-1-one CAS Name: 2-[[(E)-(2-hydroxy-4-oxo-1-cyclohexa-2,5-dienylidene)methyl]amino]-4-(phenylmethyl)-1-phthalazinone IUPAC Name: 4-benzyl-2-[[(E)-(2-hydroxy-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]amino]phthalazin-1-one Traditional Name: 4-benzyl-2-[[(E)-(2-hydroxy-4-keto-cyclohexa-2,5-dien-1-ylidene)methyl]amino]phthalazin-1-one Formula: C22H17N3O3 MolecularWeight: 371.38868

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=NN(C(=O)C3=CC=CC=C32)NC=C4C=CC(=O)C=C4O

Isomeric SMILES

C1=CC=C(C=C1)CC2=NN(C(=O)C3=CC=CC=C32)N/C=C/4\C=CC(=O)C=C4O

InChI

InChI=1S/C22H17N3O3/c26-17-11-10-16(21(27)13-17)14-23-25-22(28)19-9-5-4-8-18(19)20(24-25)12-15-6-2-1-3-7-15/h1-11,13-14,23,27H,12H2/b16-14+