2-[2-azanyl-3-(4-heptylphenyl)propyl]butane-1,4-diol

Systemtic Name: 2-[2-azanyl-3-(4-heptylphenyl)propyl]butane-1,4-diol Openeye Name: 2-[2-amino-3-(4-heptylphenyl)propyl]butane-1,4-diol CAS Name: 2-[2-amino-3-(4-heptylphenyl)propyl]butane-1,4-diol IUPAC Name: 2-[2-amino-3-(4-heptylphenyl)propyl]butane-1,4-diol Traditional Name: 2-[2-amino-3-(4-heptylphenyl)propyl]butane-1,4-diol Formula: C20H35NO2 MolecularWeight: 321.4974

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)CC(CC(CCO)CO)N

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)CC(CC(CCO)CO)N

InChI

InChI=1S/C20H35NO2/c1-2-3-4-5-6-7-17-8-10-18(11-9-17)14-20(21)15-19(16-23)12-13-22/h8-11,19-20,22-23H,2-7,12-16,21H2,1H3