(6Z)-6-(2,4-diphenyl-1H-pyrimidin-6-ylidene)-3-heptoxy-cyclohexa-2,4-dien-1-one

Systemtic Name: (6Z)-6-(2,4-diphenyl-1H-pyrimidin-6-ylidene)-3-heptoxy-cyclohexa-2,4-dien-1-one Openeye Name: (6Z)-6-(2,4-diphenyl-1H-pyrimidin-6-ylidene)-3-heptoxy-cyclohexa-2,4-dien-1-one CAS Name: (6Z)-6-(2,4-diphenyl-1H-pyrimidin-6-ylidene)-3-heptoxy-1-cyclohexa-2,4-dienone IUPAC Name: (6Z)-6-(2,4-diphenyl-1H-pyrimidin-6-ylidene)-3-heptoxycyclohexa-2,4-dien-1-one Traditional Name: (6Z)-6-(2,4-diphenyl-1H-pyrimidin-6-ylidene)-3-heptoxy-cyclohexa-2,4-dien-1-one Formula: C29H30N2O2 MolecularWeight: 438.5607

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC(=O)C(=C2C=C(N=C(N2)C3=CC=CC=C3)C4=CC=CC=C4)C=C1

Isomeric SMILES

CCCCCCCOC1=CC(=O)/C(=C\2/C=C(N=C(N2)C3=CC=CC=C3)C4=CC=CC=C4)/C=C1

InChI

InChI=1S/C29H30N2O2/c1-2-3-4-5-12-19-33-24-17-18-25(28(32)20-24)27-21-26(22-13-8-6-9-14-22)30-29(31-27)23-15-10-7-11-16-23/h6-11,13-18,20-21H,2-5,12,19H2,1H3,(H,30,31)/b27-25-