dodecyl [1-naphthalen-1-yloxy-3-(propan-2-ylamino)propan-2-yl] sulfate

Systemtic Name: dodecyl [1-naphthalen-1-yloxy-3-(propan-2-ylamino)propan-2-yl] sulfate Openeye Name: dodecyl [1-[(isopropylamino)methyl]-2-(1-naphthyloxy)ethyl] sulfate CAS Name: sulfuric acid dodecyl [1-(1-naphthalenyloxy)-3-(propan-2-ylamino)propan-2-yl] ester IUPAC Name: dodecyl [1-naphthalen-1-yloxy-3-(propan-2-ylamino)propan-2-yl] sulfate Traditional Name: sulfuric acid [1-[(isopropylamino)methyl]-2-(1-naphthoxy)ethyl] lauryl ester Formula: C28H45NO5S MolecularWeight: 507.7256

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOS(=O)(=O)OC(CNC(C)C)COC1=CC=CC2=CC=CC=C21

Isomeric SMILES

CCCCCCCCCCCCOS(=O)(=O)OC(CNC(C)C)COC1=CC=CC2=CC=CC=C21

InChI

InChI=1S/C28H45NO5S/c1-4-5-6-7-8-9-10-11-12-15-21-33-35(30,31)34-26(22-29-24(2)3)23-32-28-20-16-18-25-17-13-14-19-27(25)28/h13-14,16-20,24,26,29H,4-12,15,21-23H2,1-3H3