6-[4-[4-(diphenylmethyl)piperazin-1-ium-1-ylidene]-6-methyl-1H-pyrimidin-2-ylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[4-[4-(diphenylmethyl)piperazin-1-ium-1-ylidene]-6-methyl-1H-pyrimidin-2-ylidene]cyclohexa-2,4-dien-1-one Openeye Name: 6-[4-(4-benzhydrylpiperazin-1-ium-1-ylidene)-6-methyl-1H-pyrimidin-2-ylidene]cyclohexa-2,4-dien-1-one CAS Name: 6-[4-[4-(diphenylmethyl)-1-piperazin-1-iumylidene]-6-methyl-1H-pyrimidin-2-ylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 6-[4-(4-benzhydrylpiperazin-1-ium-1-ylidene)-6-methyl-1H-pyrimidin-2-ylidene]cyclohexa-2,4-dien-1-one Traditional Name: 6-[4-(4-benzhydrylpiperazin-1-ium-1-ylidene)-6-methyl-1H-pyrimidin-2-ylidene]cyclohexa-2,4-dien-1-one Formula: C28H29N4O+ MolecularWeight: 437.55606

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[N+]2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)NC(=C5C=CC=CC5=O)N1

Isomeric SMILES

CC1=CC(=[N+]2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)NC(=C5C=CC=CC5=O)N1

InChI

InChI=1S/C28H28N4O/c1-21-20-26(30-28(29-21)24-14-8-9-15-25(24)33)31-16-18-32(19-17-31)27(22-10-4-2-5-11-22)23-12-6-3-7-13-23/h2-15,20,27H,16-19H2,1H3,(H,29,30,33)/p+1