methyl (E,4E)-4-(3-diphenylphosphanylcyclohexa-2,4-dien-1-ylidene)but-2-enoate

Systemtic Name: methyl (E,4E)-4-(3-diphenylphosphanylcyclohexa-2,4-dien-1-ylidene)but-2-enoate Openeye Name: methyl (E,4E)-4-(3-diphenylphosphanylcyclohexa-2,4-dien-1-ylidene)but-2-enoate CAS Name: (E,4E)-4-(3-diphenylphosphino-1-cyclohexa-2,4-dienylidene)-2-butenoic acid methyl ester IUPAC Name: methyl (E,4E)-4-(3-diphenylphosphanylcyclohexa-2,4-dien-1-ylidene)but-2-enoate Traditional Name: (E,4E)-4-(3-diphenylphosphinocyclohexa-2,4-dien-1-ylidene)but-2-enoic acid methyl ester Formula: C23H21O2P MolecularWeight: 360.385401

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=CC=C1CC=CC(=C1)P(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

COC(=O)/C=C/C=C/1\CC=CC(=C1)P(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C23H21O2P/c1-25-23(24)17-9-11-19-10-8-16-22(18-19)26(20-12-4-2-5-13-20)21-14-6-3-7-15-21/h2-9,11-18H,10H2,1H3/b17-9+,19-11+