(Z)-3-methyl-5-(2-phenylethynyl)non-4-enal

Systemtic Name: (Z)-3-methyl-5-(2-phenylethynyl)non-4-enal Openeye Name: (Z)-3-methyl-5-(2-phenylethynyl)non-4-enal CAS Name: (Z)-3-methyl-5-(2-phenylethynyl)-4-nonenal IUPAC Name: (Z)-3-methyl-5-(2-phenylethynyl)non-4-enal Traditional Name: (Z)-5-butyl-3-methyl-7-phenyl-hept-4-en-6-ynal Formula: C18H22O MolecularWeight: 254.36668

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=CC(C)CC=O)C#CC1=CC=CC=C1

Isomeric SMILES

CCCC/C(=C/C(C)CC=O)/C#CC1=CC=CC=C1

InChI

InChI=1S/C18H22O/c1-3-4-8-18(15-16(2)13-14-19)12-11-17-9-6-5-7-10-17/h5-7,9-10,14-16H,3-4,8,13H2,1-2H3/b18-15-