(E)-1-[2-(2-azanylpropan-2-yl)phenyl]octadec-9-en-1-one

Systemtic Name: (E)-1-[2-(2-azanylpropan-2-yl)phenyl]octadec-9-en-1-one Openeye Name: (E)-1-[2-(1-amino-1-methyl-ethyl)phenyl]octadec-9-en-1-one CAS Name: (E)-1-[2-(2-aminopropan-2-yl)phenyl]-9-octadecen-1-one IUPAC Name: (E)-1-[2-(2-aminopropan-2-yl)phenyl]octadec-9-en-1-one Traditional Name: (E)-1-[2-(1-amino-1-methyl-ethyl)phenyl]octadec-9-en-1-one Formula: C27H45NO MolecularWeight: 399.6523

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)C1=CC=CC=C1C(C)(C)N

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)C1=CC=CC=C1C(C)(C)N

InChI

InChI=1S/C27H45NO/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23-26(29)24-21-19-20-22-25(24)27(2,3)28/h11-12,19-22H,4-10,13-18,23,28H2,1-3H3/b12-11+