4-[cyclohexa-2,5-dien-1-ylidene-(3-methoxyphenyl)methyl]-1,1,5-trimethyl-2-phenyl-pyrazol-1-ium-3-one

Systemtic Name: 4-[cyclohexa-2,5-dien-1-ylidene-(3-methoxyphenyl)methyl]-1,1,5-trimethyl-2-phenyl-pyrazol-1-ium-3-one Openeye Name: 4-[cyclohexa-2,5-dien-1-ylidene-(3-methoxyphenyl)methyl]-1,1,5-trimethyl-2-phenyl-pyrazol-1-ium-3-one CAS Name: 4-[1-cyclohexa-2,5-dienylidene-(3-methoxyphenyl)methyl]-1,1,5-trimethyl-2-phenyl-3-pyrazol-1-iumone IUPAC Name: 4-[cyclohexa-2,5-dien-1-ylidene-(3-methoxyphenyl)methyl]-1,1,5-trimethyl-2-phenylpyrazol-1-ium-3-one Traditional Name: 4-[cyclohexa-2,5-dien-1-ylidene-(3-methoxyphenyl)methyl]-1,1,5-trimethyl-2-phenyl-3-pyrazolin-1-ium-3-one Formula: C26H27N2O2+ MolecularWeight: 399.50478

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N([N+]1(C)C)C2=CC=CC=C2)C(=C3C=CCC=C3)C4=CC(=CC=C4)OC

Isomeric SMILES

CC1=C(C(=O)N([N+]1(C)C)C2=CC=CC=C2)C(=C3C=CCC=C3)C4=CC(=CC=C4)OC

InChI

InChI=1S/C26H27N2O2/c1-19-24(26(29)27(28(19,2)3)22-15-9-6-10-16-22)25(20-12-7-5-8-13-20)21-14-11-17-23(18-21)30-4/h6-18H,5H2,1-4H3/q+1