[2-methoxy-4-[[[(E)-octadec-9-enoyl]amino]methyl]phenyl] ethanoate

Systemtic Name: [2-methoxy-4-[[[(E)-octadec-9-enoyl]amino]methyl]phenyl] ethanoate Openeye Name: [2-methoxy-4-[[[(E)-octadec-9-enoyl]amino]methyl]phenyl] acetate CAS Name: acetic acid [2-methoxy-4-[[[(E)-1-oxooctadec-9-enyl]amino]methyl]phenyl] ester IUPAC Name: [2-methoxy-4-[[[(E)-octadec-9-enoyl]amino]methyl]phenyl] acetate Traditional Name: acetic acid [2-methoxy-4-[[[(E)-octadec-9-enoyl]amino]methyl]phenyl] ester Formula: C28H45NO4 MolecularWeight: 459.6612

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)NCC1=CC(=C(C=C1)OC(=O)C)OC

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)NCC1=CC(=C(C=C1)OC(=O)C)OC

InChI

InChI=1S/C28H45NO4/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-28(31)29-23-25-20-21-26(33-24(2)30)27(22-25)32-3/h11-12,20-22H,4-10,13-19,23H2,1-3H3,(H,29,31)/b12-11+