N-[2-(2,2-dimethylpropanoyl)-3,6-bis(oxidanylidene)-4-phenylazanyl-cyclohexa-1,4-dien-1-yl]-N-phenyl-benzenecarboximidamide

Systemtic Name: N-[2-(2,2-dimethylpropanoyl)-3,6-bis(oxidanylidene)-4-phenylazanyl-cyclohexa-1,4-dien-1-yl]-N-phenyl-benzenecarboximidamide Openeye Name: N-[4-anilino-2-(2,2-dimethylpropanoyl)-3,6-dioxo-cyclohexa-1,4-dien-1-yl]-N-phenyl-benzamidine CAS Name: N-[4-anilino-2-(2,2-dimethyl-1-oxopropyl)-3,6-dioxo-1-cyclohexa-1,4-dienyl]-N-phenylbenzenecarboximidamide IUPAC Name: N-[4-anilino-2-(2,2-dimethylpropanoyl)-3,6-dioxocyclohexa-1,4-dien-1-yl]-N-phenylbenzenecarboximidamide Traditional Name: N-(4-anilino-3,6-diketo-2-pivaloyl-cyclohexa-1,4-dien-1-yl)-N-phenyl-benzamidine Formula: C30H27N3O3 MolecularWeight: 477.55368

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C1=C(C(=O)C=C(C1=O)NC2=CC=CC=C2)N(C3=CC=CC=C3)C(=N)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C(=O)C1=C(C(=O)C=C(C1=O)NC2=CC=CC=C2)N(C3=CC=CC=C3)C(=N)C4=CC=CC=C4

InChI

InChI=1S/C30H27N3O3/c1-30(2,3)28(36)25-26(24(34)19-23(27(25)35)32-21-15-9-5-10-16-21)33(22-17-11-6-12-18-22)29(31)20-13-7-4-8-14-20/h4-19,31-32H,1-3H3