(E,2S,3R)-2-azanyl-5-(4-pentylphenyl)pent-4-ene-1,3-diol

Systemtic Name: (E,2S,3R)-2-azanyl-5-(4-pentylphenyl)pent-4-ene-1,3-diol Openeye Name: (E,2S,3R)-2-amino-5-(4-pentylphenyl)pent-4-ene-1,3-diol CAS Name: (E,2S,3R)-2-amino-5-(4-pentylphenyl)-4-pentene-1,3-diol IUPAC Name: (E,2S,3R)-2-amino-5-(4-pentylphenyl)pent-4-ene-1,3-diol Traditional Name: (E,2S,3R)-2-amino-5-(4-amylphenyl)pent-4-ene-1,3-diol Formula: C16H25NO2 MolecularWeight: 263.3752

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C=CC(C(CO)N)O

Isomeric SMILES

CCCCCC1=CC=C(C=C1)/C=C/[C@H]([C@H](CO)N)O

InChI

InChI=1S/C16H25NO2/c1-2-3-4-5-13-6-8-14(9-7-13)10-11-16(19)15(17)12-18/h6-11,15-16,18-19H,2-5,12,17H2,1H3/b11-10+/t15-,16+/m0/s1