(1S,2R,3S)-3-azanyl-1-cyclopropyl-4-(4-methoxyphenyl)butane-1,2-diol

Systemtic Name: (1S,2R,3S)-3-azanyl-1-cyclopropyl-4-(4-methoxyphenyl)butane-1,2-diol Openeye Name: (1S,2R,3S)-3-amino-1-cyclopropyl-4-(4-methoxyphenyl)butane-1,2-diol CAS Name: (1S,2R,3S)-3-amino-1-cyclopropyl-4-(4-methoxyphenyl)butane-1,2-diol IUPAC Name: (1S,2R,3S)-3-amino-1-cyclopropyl-4-(4-methoxyphenyl)butane-1,2-diol Traditional Name: (1S,2R,3S)-3-amino-1-cyclopropyl-4-(4-methoxyphenyl)butane-1,2-diol Formula: C14H21NO3 MolecularWeight: 251.32144

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC(C(C(C2CC2)O)O)N

Isomeric SMILES

COC1=CC=C(C=C1)C[C@@H]([C@H]([C@H](C2CC2)O)O)N

InChI

InChI=1S/C14H21NO3/c1-18-11-6-2-9(3-7-11)8-12(15)14(17)13(16)10-4-5-10/h2-3,6-7,10,12-14,16-17H,4-5,8,15H2,1H3/t12-,13-,14+/m0/s1