5-(naphthalen-1-ylcarbonylamino)-6-oxidanylidene-6-(16-oxidanylidenehexadecanoylamino)hexanoic acid

Systemtic Name: 5-(naphthalen-1-ylcarbonylamino)-6-oxidanylidene-6-(16-oxidanylidenehexadecanoylamino)hexanoic acid Openeye Name: 5-(naphthalene-1-carbonylamino)-6-oxo-6-(16-oxohexadecanoylamino)hexanoic acid CAS Name: 6-(1,16-dioxohexadecylamino)-5-[[1-naphthalenyl(oxo)methyl]amino]-6-oxohexanoic acid IUPAC Name: 5-(naphthalene-1-carbonylamino)-6-oxo-6-(16-oxohexadecanoylamino)hexanoic acid Traditional Name: 6-keto-6-(16-ketohexadecanoylamino)-5-(1-naphthoylamino)hexanoic acid Formula: C33H46N2O6 MolecularWeight: 566.72814

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2C(=O)NC(CCCC(=O)O)C(=O)NC(=O)CCCCCCCCCCCCCCC=O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2C(=O)NC(CCCC(=O)O)C(=O)NC(=O)CCCCCCCCCCCCCCC=O

InChI

InChI=1S/C33H46N2O6/c36-25-15-11-9-7-5-3-1-2-4-6-8-10-12-23-30(37)35-33(41)29(22-17-24-31(38)39)34-32(40)28-21-16-19-26-18-13-14-20-27(26)28/h13-14,16,18-21,25,29H,1-12,15,17,22-24H2,(H,34,40)(H,38,39)(H,35,37,41)