2-[[(E)-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)methyl]amino]-4-(phenylmethyl)phthalazin-1-one

Systemtic Name: 2-[[(E)-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)methyl]amino]-4-(phenylmethyl)phthalazin-1-one Openeye Name: 4-benzyl-2-[[(E)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]phthalazin-1-one CAS Name: 2-[[(E)-(6-oxo-1-cyclohexa-2,4-dienylidene)methyl]amino]-4-(phenylmethyl)-1-phthalazinone IUPAC Name: 4-benzyl-2-[[(E)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]phthalazin-1-one Traditional Name: 4-benzyl-2-[[(E)-(6-ketocyclohexa-2,4-dien-1-ylidene)methyl]amino]phthalazin-1-one Formula: C22H17N3O2 MolecularWeight: 355.38928

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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=CC4=O

Isomeric SMILES

C1=CC=C(C=C1)CC2=NN(C(=O)C3=CC=CC=C32)N/C=C/4\C=CC=CC4=O

InChI

InChI=1S/C22H17N3O2/c26-21-13-7-4-10-17(21)15-23-25-22(27)19-12-6-5-11-18(19)20(24-25)14-16-8-2-1-3-9-16/h1-13,15,23H,14H2/b17-15+