6-(1-azanyl-1-oxidanylidene-hexadecan-3-yl)oxy-5-benzamido-6-oxidanylidene-hexanoic acid

Systemtic Name: 6-(1-azanyl-1-oxidanylidene-hexadecan-3-yl)oxy-5-benzamido-6-oxidanylidene-hexanoic acid Openeye Name: 6-[1-(2-amino-2-oxo-ethyl)tetradecoxy]-5-benzamido-6-oxo-hexanoic acid CAS Name: 6-(1-amino-1-oxohexadecan-3-yl)oxy-5-benzamido-6-oxohexanoic acid IUPAC Name: 6-(1-amino-1-oxohexadecan-3-yl)oxy-5-benzamido-6-oxohexanoic acid Traditional Name: 6-[1-(2-amino-2-keto-ethyl)tetradecoxy]-5-benzamido-6-keto-hexanoic acid Formula: C29H46N2O6 MolecularWeight: 518.68534

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(CC(=O)N)OC(=O)C(CCCC(=O)O)NC(=O)C1=CC=CC=C1

Isomeric SMILES

CCCCCCCCCCCCCC(CC(=O)N)OC(=O)C(CCCC(=O)O)NC(=O)C1=CC=CC=C1

InChI

InChI=1S/C29H46N2O6/c1-2-3-4-5-6-7-8-9-10-11-15-19-24(22-26(30)32)37-29(36)25(20-16-21-27(33)34)31-28(35)23-17-13-12-14-18-23/h12-14,17-18,24-25H,2-11,15-16,19-22H2,1H3,(H2,30,32)(H,31,35)(H,33,34)