4-(3-octan-4-yl-1,4-dihydropyrimidin-2-ylidene)cyclohexa-2,5-dien-1-one

Systemtic Name: 4-(3-octan-4-yl-1,4-dihydropyrimidin-2-ylidene)cyclohexa-2,5-dien-1-one Openeye Name: 4-[3-(1-propylpentyl)-1,4-dihydropyrimidin-2-ylidene]cyclohexa-2,5-dien-1-one CAS Name: 4-(3-octan-4-yl-1,4-dihydropyrimidin-2-ylidene)-1-cyclohexa-2,5-dienone IUPAC Name: 4-(3-octan-4-yl-1,4-dihydropyrimidin-2-ylidene)cyclohexa-2,5-dien-1-one Traditional Name: 4-[3-(1-propylpentyl)-1,4-dihydropyrimidin-2-ylidene]cyclohexa-2,5-dien-1-one Formula: C18H26N2O MolecularWeight: 286.41184

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCC)N1CC=CNC1=C2C=CC(=O)C=C2

Isomeric SMILES

CCCCC(CCC)N1CC=CNC1=C2C=CC(=O)C=C2

InChI

InChI=1S/C18H26N2O/c1-3-5-8-16(7-4-2)20-14-6-13-19-18(20)15-9-11-17(21)12-10-15/h6,9-13,16,19H,3-5,7-8,14H2,1-2H3