2-azanyl-2-[(2S)-6-octyl-1,2,3,4-tetrahydronaphthalen-2-yl]propane-1,3-diol

Systemtic Name: 2-azanyl-2-[(2S)-6-octyl-1,2,3,4-tetrahydronaphthalen-2-yl]propane-1,3-diol Openeye Name: 2-amino-2-[(2S)-6-octyltetralin-2-yl]propane-1,3-diol CAS Name: 2-amino-2-[(2S)-6-octyl-1,2,3,4-tetrahydronaphthalen-2-yl]propane-1,3-diol IUPAC Name: 2-amino-2-[(2S)-6-octyl-1,2,3,4-tetrahydronaphthalen-2-yl]propane-1,3-diol Traditional Name: 2-amino-2-[(2S)-6-octyltetralin-2-yl]propane-1,3-diol Formula: C21H35NO2 MolecularWeight: 333.5081

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC2=C(CC(CC2)C(CO)(CO)N)C=C1

Isomeric SMILES

CCCCCCCCC1=CC2=C(C[C@H](CC2)C(CO)(CO)N)C=C1

InChI

InChI=1S/C21H35NO2/c1-2-3-4-5-6-7-8-17-9-10-19-14-20(12-11-18(19)13-17)21(22,15-23)16-24/h9-10,13,20,23-24H,2-8,11-12,14-16,22H2,1H3/t20-/m0/s1