[1-oxidanylidene-1-[(2-oxidanylidene-2-phenylmethoxy-ethyl)amino]heptadecan-3-yl] 12-methyltridec-11-enoate

Systemtic Name: [1-oxidanylidene-1-[(2-oxidanylidene-2-phenylmethoxy-ethyl)amino]heptadecan-3-yl] 12-methyltridec-11-enoate Openeye Name: 1-[2-[(2-benzyloxy-2-oxo-ethyl)amino]-2-oxo-ethyl]pentadecyl 12-methyltridec-11-enoate CAS Name: 12-methyl-11-tridecenoic acid [1-oxo-1-[(2-oxo-2-phenylmethoxyethyl)amino]heptadecan-3-yl] ester IUPAC Name: [1-oxo-1-[(2-oxo-2-phenylmethoxyethyl)amino]heptadecan-3-yl] 12-methyltridec-11-enoate Traditional Name: 12-methyltridec-11-enoic acid 1-[2-[(2-benzoxy-2-keto-ethyl)amino]-2-keto-ethyl]pentadecyl ester Formula: C40H67NO5 MolecularWeight: 641.96368

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC(CC(=O)NCC(=O)OCC1=CC=CC=C1)OC(=O)CCCCCCCCCC=C(C)C

Isomeric SMILES

CCCCCCCCCCCCCCC(CC(=O)NCC(=O)OCC1=CC=CC=C1)OC(=O)CCCCCCCCCC=C(C)C

InChI

InChI=1S/C40H67NO5/c1-4-5-6-7-8-9-10-11-12-16-19-25-30-37(32-38(42)41-33-40(44)45-34-36-28-23-21-24-29-36)46-39(43)31-26-20-17-14-13-15-18-22-27-35(2)3/h21,23-24,27-29,37H,4-20,22,25-26,30-34H2,1-3H3,(H,41,42)