(4S,5R,6S)-6-azanyl-2-methyl-11-phenyl-undecane-4,5-diol

Systemtic Name: (4S,5R,6S)-6-azanyl-2-methyl-11-phenyl-undecane-4,5-diol Openeye Name: (4S,5R,6S)-6-amino-2-methyl-11-phenyl-undecane-4,5-diol CAS Name: (4S,5R,6S)-6-amino-2-methyl-11-phenylundecane-4,5-diol IUPAC Name: (4S,5R,6S)-6-amino-2-methyl-11-phenylundecane-4,5-diol Traditional Name: (4S,5R,6S)-6-amino-2-methyl-11-phenyl-undecane-4,5-diol Formula: C18H31NO2 MolecularWeight: 293.44424

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H31NO2/c1-14(2)13-17(20)18(21)16(19)12-8-4-7-11-15-9-5-3-6-10-15/h3,5-6,9-10,14,16-18,20-21H,4,7-8,11-13,19H2,1-2H3/t16-,17-,18+/m0/s1