(1-azanyl-2-oxidanyl-butan-2-yl) octadecanoate

Systemtic Name: (1-azanyl-2-oxidanyl-butan-2-yl) octadecanoate Openeye Name: [1-(aminomethyl)-1-hydroxy-propyl] octadecanoate CAS Name: octadecanoic acid (1-amino-2-hydroxybutan-2-yl) ester IUPAC Name: (1-amino-2-hydroxybutan-2-yl) octadecanoate Traditional Name: stearic acid [1-(aminomethyl)-1-hydroxy-propyl] ester Formula: C22H45NO3 MolecularWeight: 371.5976

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OC(CC)(CN)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OC(CC)(CN)O

InChI

InChI=1S/C22H45NO3/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21(24)26-22(25,4-2)20-23/h25H,3-20,23H2,1-2H3