phenyl 3-(2-azanylpropan-2-yl)tridecanoate

Systemtic Name: phenyl 3-(2-azanylpropan-2-yl)tridecanoate Openeye Name: phenyl 3-(1-amino-1-methyl-ethyl)tridecanoate CAS Name: 3-(2-aminopropan-2-yl)tridecanoic acid phenyl ester IUPAC Name: phenyl 3-(2-aminopropan-2-yl)tridecanoate Traditional Name: 3-(1-amino-1-methyl-ethyl)tridecanoic acid phenyl ester Formula: C22H37NO2 MolecularWeight: 347.53468

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(CC(=O)OC1=CC=CC=C1)C(C)(C)N

Isomeric SMILES

CCCCCCCCCCC(CC(=O)OC1=CC=CC=C1)C(C)(C)N

InChI

InChI=1S/C22H37NO2/c1-4-5-6-7-8-9-10-12-15-19(22(2,3)23)18-21(24)25-20-16-13-11-14-17-20/h11,13-14,16-17,19H,4-10,12,15,18,23H2,1-3H3