2-[methyl-(4-methylphenyl)carbonyl-amino]ethyl (E)-octadec-9-enoate

Systemtic Name: 2-[methyl-(4-methylphenyl)carbonyl-amino]ethyl (E)-octadec-9-enoate Openeye Name: 2-[methyl-(4-methylbenzoyl)amino]ethyl (E)-octadec-9-enoate CAS Name: (E)-9-octadecenoic acid 2-[methyl-[(4-methylphenyl)-oxomethyl]amino]ethyl ester IUPAC Name: 2-[methyl-(4-methylbenzoyl)amino]ethyl (E)-octadec-9-enoate Traditional Name: (E)-octadec-9-enoic acid 2-[methyl(p-toluoyl)amino]ethyl ester Formula: C29H47NO3 MolecularWeight: 457.68838

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)OCCN(C)C(=O)C1=CC=C(C=C1)C

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)OCCN(C)C(=O)C1=CC=C(C=C1)C

InChI

InChI=1S/C29H47NO3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-28(31)33-25-24-30(3)29(32)27-22-20-26(2)21-23-27/h11-12,20-23H,4-10,13-19,24-25H2,1-3H3/b12-11+