[1-oxidanylidene-1-[(3-oxidanyl-1-oxidanylidene-1-phenylmethoxy-propan-2-yl)amino]tetradecan-3-yl] nonanoate

Systemtic Name: [1-oxidanylidene-1-[(3-oxidanyl-1-oxidanylidene-1-phenylmethoxy-propan-2-yl)amino]tetradecan-3-yl] nonanoate Openeye Name: 1-[2-[[2-benzyloxy-1-(hydroxymethyl)-2-oxo-ethyl]amino]-2-oxo-ethyl]dodecyl nonanoate CAS Name: nonanoic acid [1-[(3-hydroxy-1-oxo-1-phenylmethoxypropan-2-yl)amino]-1-oxotetradecan-3-yl] ester IUPAC Name: [1-[(3-hydroxy-1-oxo-1-phenylmethoxypropan-2-yl)amino]-1-oxotetradecan-3-yl] nonanoate Traditional Name: pelargonic acid 1-[2-[(2-benzoxy-2-keto-1-methylol-ethyl)amino]-2-keto-ethyl]dodecyl ester Formula: C33H55NO6 MolecularWeight: 561.7929

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(CC(=O)NC(CO)C(=O)OCC1=CC=CC=C1)OC(=O)CCCCCCCC

Isomeric SMILES

CCCCCCCCCCCC(CC(=O)NC(CO)C(=O)OCC1=CC=CC=C1)OC(=O)CCCCCCCC

InChI

InChI=1S/C33H55NO6/c1-3-5-7-9-11-12-13-14-19-23-29(40-32(37)24-20-15-10-8-6-4-2)25-31(36)34-30(26-35)33(38)39-27-28-21-17-16-18-22-28/h16-18,21-22,29-30,35H,3-15,19-20,23-27H2,1-2H3,(H,34,36)