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

Systemtic Name: 6-(1-azanyl-1-oxidanylidene-hexadecan-3-yl)oxy-6-oxidanylidene-5-(phenoxycarbonylamino)hexanoic acid Openeye Name: 6-[1-(2-amino-2-oxo-ethyl)tetradecoxy]-6-oxo-5-(phenoxycarbonylamino)hexanoic acid CAS Name: 6-(1-amino-1-oxohexadecan-3-yl)oxy-6-oxo-5-[[oxo(phenoxy)methyl]amino]hexanoic acid IUPAC Name: 6-(1-amino-1-oxohexadecan-3-yl)oxy-6-oxo-5-(phenoxycarbonylamino)hexanoic acid Traditional Name: 6-[1-(2-amino-2-keto-ethyl)tetradecoxy]-5-(carbophenoxyamino)-6-keto-hexanoic acid Formula: C29H46N2O7 MolecularWeight: 534.68474

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(CC(=O)N)OC(=O)C(CCCC(=O)O)NC(=O)OC1=CC=CC=C1

Isomeric SMILES

CCCCCCCCCCCCCC(CC(=O)N)OC(=O)C(CCCC(=O)O)NC(=O)OC1=CC=CC=C1

InChI

InChI=1S/C29H46N2O7/c1-2-3-4-5-6-7-8-9-10-11-13-19-24(22-26(30)32)37-28(35)25(20-16-21-27(33)34)31-29(36)38-23-17-14-12-15-18-23/h12,14-15,17-18,24-25H,2-11,13,16,19-22H2,1H3,(H2,30,32)(H,31,36)(H,33,34)